TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T33969 ATP-binding cassette transporter B11 D00BCP Chlorpropamide Approved 2727 C10H13ClN2O3S 276.74 CCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00FGO Melphalan Approved 460612 C13H18Cl2N2O2 305.2 C1=CC(=CC=C1C[C@@H](C(=O)O)N)N(CCCl)CCCl IC50 = 93750 nM Poor binder T33969 ATP-binding cassette transporter B11 D00IBN Piroxicam Approved 54676228 C15H13N3O4S 331.3 CN1C(=C(C2=CC=CC=C2S1(=O)=O)O)C(=O)NC3=CC=CC=N3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00KVO Albendazole Approved 2082 C12H15N3O2S 265.33 CCCSC1=CC2=C(C=C1)N=C(N2)NC(=O)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00MIN Propylthiouracil Approved 657298 C7H10N2OS 170.23 CCCC1=CC(=O)NC(=S)N1 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00MYQ Protriptyline Approved 4976 C19H21N 263.4 CNCCCC1C2=CC=CC=C2C=CC3=CC=CC=C13 IC50 = 128600 nM Poor binder T33969 ATP-binding cassette transporter B11 D00NKB Triamterene Approved 5546 C12H11N7 253.26 C1=CC=C(C=C1)C2=NC3=C(N=C(N=C3N=C2N)N)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00USF Trazodone Approved 5533 C19H22ClN5O 371.9 C1CN(CCN1CCCN2C(=O)N3C=CC=CC3=N2)C4=CC(=CC=C4)Cl IC50 = 90000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00WAM Hydroflumethiazide Approved 3647 C8H8F3N3O4S2 331.3 C1NC2=C(C=C(C(=C2)C(F)(F)F)S(=O)(=O)N)S(=O)(=O)N1 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00WCX Bezafibrate Approved 39042 C19H20ClNO4 361.8 CC(C)(C(=O)O)OC1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)Cl IC50 = 180800 nM Poor binder T33969 ATP-binding cassette transporter B11 D00WUF Pregabalin Approved 5486971 C8H17NO2 159.23 CC(C)C[C@@H](CC(=O)O)CN IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00XUN Etidronate Disodium Approved 23894 C2H6Na2O7P2 249.99 CC(O)(P(=O)(O)[O-])P(=O)(O)[O-].[Na+].[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00YZA Thiotepa Approved 5453 C6H12N3PS 189.22 C1CN1P(=S)(N2CC2)N3CC3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01AZG Risperidone Approved 5073 C23H27FN4O2 410.5 CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01DBQ Teniposide Approved 452548 C32H32O13S 656.7 COC1=CC(=CC(=C1O)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@@H](C4=CC5=C(C=C24)OCO5)O[C@H]6[C@@H]([C@H]([C@H]7[C@H](O6)CO[C@H](O7)C8=CC=CS8)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01FGR Diphenhydramine Approved 3100 C17H21NO 255.35 CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2 IC50 ~ 135000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01GBY Desloratadine Approved 124087 C19H19ClN2 310.8 C1CC2=C(C=CC(=C2)Cl)C(=C3CCNCC3)C4=C1C=CC=N4 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01KHH Cyclobenzaprine Approved 2895 C20H21N 275.4 CN(C)CCC=C1C2=CC=CC=C2C=CC3=CC=CC=C31 IC50 = 107400 nM Poor binder T33969 ATP-binding cassette transporter B11 D01KKQ Raltitrexed Approved 135400182 C21H22N4O6S 458.5 CC1=NC2=C(C=C(C=C2)CN(C)C3=CC=C(S3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N1 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01MDT Tizanidine Approved 5487 C9H8ClN5S 253.71 C1CN=C(N1)NC2=C(C=CC3=NSN=C32)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01MUR Brinzolamide Approved 68844 C12H21N3O5S3 383.5 CCN[C@H]1CN(S(=O)(=O)C2=C1C=C(S2)S(=O)(=O)N)CCCOC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01OXI DTI-015 Approved 2578 C5H9Cl2N3O2 214.05 C(CCl)NC(=O)N(CCCl)N=O IC50 = 97210 nM Poor binder T33969 ATP-binding cassette transporter B11 D01STB Ramipril Approved 5362129 C23H32N2O5 416.5 CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2[C@H]3CCC[C@H]3C[C@H]2C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01UTL Desipramine Approved 2995 C18H22N2 266.4 CNCCCN1C2=CC=CC=C2CCC3=CC=CC=C31 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01UXC Atenolol Approved 2249 C14H22N2O3 266.34 CC(C)NCC(COC1=CC=C(C=C1)CC(=O)N)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01XNB Omeprazole Approved 4594 C17H19N3O3S 345.4 CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC IC50 = 75000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01XYJ Zidovudine Approved 35370 C10H13N5O4 267.24 CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)N=[N+]=[N-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01ZII Chlorpromazine Approved 2726 C17H19ClN2S 318.9 CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl IC50 = 90970 nM Poor binder T33969 ATP-binding cassette transporter B11 D01ZSO Moclobemide Approved 4235 C13H17ClN2O2 268.74 C1COCCN1CCNC(=O)C2=CC=C(C=C2)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D02DGU Tretinoin Approved 444795 C20H28O2 300.4 CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)O)/C)/C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D02DPA Cimetidine Approved 2756 C10H16N6S 252.34 CC1=C(N=CN1)CSCCNC(=NC)NC#N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D02HED Perphenazine Approved 4748 C21H26ClN3OS 404 C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCO IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D02KMO Pinacidil Approved 4826 C13H19N5 245.32 CC(C(C)(C)C)N=C(NC#N)NC1=CC=NC=C1 IC50 = 161300 nM Poor binder T33969 ATP-binding cassette transporter B11 D02LCR Tiapride Approved 5467 C15H24N2O4S 328.4 CCN(CC)CCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)C)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D02NTO Tolnaftate Approved 5510 C19H17NOS 307.4 CC1=CC(=CC=C1)N(C)C(=S)OC2=CC3=CC=CC=C3C=C2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D02PAH Bendroflumethiazide Approved 2315 C15H14F3N3O4S2 421.4 C1=CC=C(C=C1)CC2NC3=C(C=C(C(=C3)C(F)(F)F)S(=O)(=O)N)S(=O)(=O)N2 IC50 = 69550 nM Poor binder T33969 ATP-binding cassette transporter B11 D02STN ABIRATERONE Approved 132971 C24H31NO 349.5 C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC=C4C5=CN=CC=C5)C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D02TLO Ifosfamide Approved 3690 C7H15Cl2N2O2P 261.079 C1CN(P(=O)(OC1)NCCCl)CCCl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D02YIZ Erythromycin Approved 12560 C37H67NO13 733.9 CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D02YPG Etomidate Approved 667484 C14H16N2O2 244.29 CCOC(=O)C1=CN=CN1[C@H](C)C2=CC=CC=C2 IC50 = 61610 nM Poor binder T33969 ATP-binding cassette transporter B11 D03CQE Gatifloxacin Approved 5379 C19H22FN3O4 375.4 CC1CN(CCN1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03DDR Quinine Approved 3034034 C20H24N2O2 324.4 COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)O IC50 = 98830 nM Poor binder T33969 ATP-binding cassette transporter B11 D03ELL Amisulpride Approved 2159 C17H27N3O4S 369.5 CCN1CCCC1CNC(=O)C2=CC(=C(C=C2OC)N)S(=O)(=O)CC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03FLC Lamotrigine Approved 3878 C9H7Cl2N5 256.089 C1=CC(=C(C(=C1)Cl)Cl)C2=C(N=C(N=N2)N)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03HJK Zithromax Approved 447043 C38H72N2O12 749 CC[C@@H]1[C@@]([C@@H]([C@H](N(C[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)C)O)(C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03JSJ Mupirocin Approved 446596 C26H44O9 500.6 C[C@H]([C@H]1[C@@H](O1)C[C@H]2CO[C@H]([C@@H]([C@@H]2O)O)C/C(=C/C(=O)OCCCCCCCCC(=O)O)/C)[C@H](C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03KQF Maprotiline Approved 4011 C20H23N 277.4 CNCCCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03NHW Ofloxacin Approved 4583 C18H20FN3O4 361.4 CC1COC2=C3N1C=C(C(=O)C3=CC(=C2N4CCN(CC4)C)F)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03QGM Sulpiride Approved 688272 C15H23N3O4S 341.4 CCN1CCC[C@H]1CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03QWT Doripenem Approved 73303 C15H24N4O6S2 420.5 C[C@@H]1[C@@H]2[C@H](C(=O)N2C(=C1S[C@H]3C[C@H](NC3)CNS(=O)(=O)N)C(=O)O)[C@@H](C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03VPC Cilostazol Approved 2754 C20H27N5O2 369.5 C1CCC(CC1)N2C(=NN=N2)CCCCOC3=CC4=C(C=C3)NC(=O)CC4 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03XOC Trilostane Approved 656583 C20H27NO3 329.4 C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CC[C@]45[C@@]3(CC(=C([C@H]4O5)O)C#N)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03YLZ Thiamphenicol Approved 27200 C12H15Cl2NO5S 356.2 CS(=O)(=O)C1=CC=C(C=C1)[C@H]([C@@H](CO)NC(=O)C(Cl)Cl)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04AAW Cidofovir Approved 60613 C8H14N3O6P 279.19 C1=CN(C(=O)N=C1N)C[C@@H](CO)OCP(=O)(O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04EGX Cabergoline Approved 54746 C26H37N5O2 451.6 CCNC(=O)N(CCCN(C)C)C(=O)[C@@H]1C[C@H]2[C@@H](CC3=CNC4=CC=CC2=C34)N(C1)CC=C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04FBR Mycophenolate mofetil Approved 5281078 C23H31NO7 433.5 CC1=C2COC(=O)C2=C(C(=C1OC)C/C=C(\\C)/CCC(=O)OCCN3CCOCC3)O IC50 = 76000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04JCN Pergolide Approved 47811 C19H26N2S 314.5 CCCN1C[C@@H](C[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)CSC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04JPJ Lomustine Approved 3950 C9H16ClN3O2 233.69 C1CCC(CC1)NC(=O)N(CCCl)N=O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04KYY Allopurinol Approved 135401907 C5H4N4O 136.11 . IC50 ~ 100000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04MSM Carbamazepine Approved 2554 C15H12N2O 236.27 C1=CC=C2C(=C1)C=CC3=CC=CC=C3N2C(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04NQI Amodiaquine Approved 2165 C20H22ClN3O 355.9 CCN(CC)CC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)O IC50 = 77760 nM Poor binder T33969 ATP-binding cassette transporter B11 D04NXQ Pefloxacin Approved 51081 C17H20FN3O3 333.36 CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04OSE Nifedipine Approved 4485 C17H18N2O6 346.3 CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC IC50 = 64000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04RGA Dinoprost Tromethamine Approved 5282415 C24H45NO8 475.6 CCCCC[C@@H](/C=C/[C@H]1[C@@H](C[C@@H]([C@@H]1C/C=C\\CCCC(=O)O)O)O)O.C(C(CO)(CO)N)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04VMT Sotalol Approved 5253 C12H20N2O3S 272.37 CC(C)NCC(C1=CC=C(C=C1)NS(=O)(=O)C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04WFD Nortriptyline Approved 4543 C19H21N 263.4 CNCCC=C1C2=CC=CC=C2CCC3=CC=CC=C31 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04XGT Benznidazole Approved 31593 C12H12N4O3 260.25 C1=CC=C(C=C1)CNC(=O)CN2C=CN=C2[N+](=O)[O-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04YMH Lumiracoxib Approved 151166 C15H13ClFNO2 293.72 CC1=CC(=C(C=C1)NC2=C(C=CC=C2Cl)F)CC(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04ZAH Piperacillin Approved 43672 C23H27N5O7S 517.6 CCN1CCN(C(=O)C1=O)C(=O)N[C@H](C2=CC=CC=C2)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O IC50 = 197400 nM Poor binder T33969 ATP-binding cassette transporter B11 D04ZTY Voglibose Approved 444020 C10H21NO7 267.28 C1[C@@H]([C@@H]([C@H]([C@@H]([C@]1(CO)O)O)O)O)NC(CO)CO IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05ARP Ganciclovir Approved 135398740 C9H13N5O4 255.23 C1=NC2=C(N1COC(CO)CO)N=C(NC2=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05EAM Pentamidine Approved 4735 C19H24N4O2 340.4 C1=CC(=CC=C1C(=N)N)OCCCCCOC2=CC=C(C=C2)C(=N)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05FTJ Mefenamic acid Approved 4044 C15H15NO2 241.28 CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)O)C IC50 = 57000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05GJW Cladribine Approved 20279 C10H12ClN5O3 285.69 C1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=C(N=C32)Cl)N)CO)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05HSC Tubocurarine Approved 6000 C37H41N2O6+ 609.7 CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C6[C@@H](CC7=CC(=C(C=C7)O)O3)[N+](CCC6=CC(=C5O)OC)(C)C)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05JNI Framycetin Approved 8378 C23H46N6O13 614.6 C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)N)O[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O[C@@H]4[C@@H]([C@H]([C@@H]([C@@H](O4)CN)O)O)N)O)O)N IC50 ~ 135000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05LBU Ticlopidine Approved 5472 C14H14ClNS 263.8 C1CN(CC2=C1SC=C2)CC3=CC=CC=C3Cl IC50 = 74000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05LEO Fluorouracil Approved 3385 C4H3FN2O2 130.08 C1=C(C(=O)NC(=O)N1)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05LKP Sulfadiazine Approved 5215 C10H10N4O2S 250.28 C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05LYX Glibenclamide Approved 3488 C23H28ClN3O5S 494 COC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3 IC50 = 146500 nM Poor binder T33969 ATP-binding cassette transporter B11 D05MFA Valacyclovir Hydrochloride Approved 135398741 C13H21ClN6O4 360.8 . IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05MQK Tadalafil Approved 110635 C22H19N3O4 389.4 CN1CC(=O)N2[C@@H](C1=O)CC3=C([C@H]2C4=CC5=C(C=C4)OCO5)NC6=CC=CC=C36 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05OFX Lacosamide Approved 219078 C13H18N2O3 250.29 CC(=O)N[C@H](COC)C(=O)NCC1=CC=CC=C1 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05UVD Timolol Approved 33624 C13H24N4O3S 316.42 CC(C)(C)NC[C@@H](COC1=NSN=C1N2CCOCC2)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05VIL Nalmefene Approved 5284594 C21H25NO3 339.4 C=C1CC[C@]2([C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)O)CCN3CC6CC6)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05VIX Gemfibrozil Approved 3463 C15H22O3 250.33 CC1=CC(=C(C=C1)C)OCCCC(C)(C)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05VLS Rofecoxib Approved 5090 C17H14O4S 314.4 CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)OC2)C3=CC=CC=C3 IC50 = 95360 nM Poor binder T33969 ATP-binding cassette transporter B11 D05ZGQ Dexchlorpheniramine Maleate Approved 5281070 C20H23ClN2O4 390.9 CN(C)CC[C@@H](C1=CC=C(C=C1)Cl)C2=CC=CC=N2.C(=C\\C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05ZIK Mirtazapine Approved 4205 C17H19N3 265.35 CN1CCN2C(C1)C3=CC=CC=C3CC4=C2N=CC=C4 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D06CTE Imiquimod Approved 57469 C14H16N4 240.3 CC(C)CN1C=NC2=C1C3=CC=CC=C3N=C2N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D06GAM Fleroxacin Approved 3357 C17H18F3N3O3 369.34 CN1CCN(CC1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)CCF)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D06OIV Tolbutamide Approved 5505 C12H18N2O3S 270.35 CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D06OVY Cefixime Approved 5362065 C16H15N5O7S2 453.5 C=CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)/C(=N\\OCC(=O)O)/C3=CSC(=N3)N)SC1)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D06PSS Nateglinide Approved 5311309 C19H27NO3 317.4 CC(C)C1CCC(CC1)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D06TNL Ethacrynic acid Approved 3278 C13H12Cl2O4 303.13 CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D06VML Seroxat Approved 43815 C19H20FNO3 329.4 C1CNC[C@H]([C@@H]1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4 IC50 = 68910 nM Poor binder T33969 ATP-binding cassette transporter B11 D06XMU Testosterone Approved 6013 C19H28O2 288.4 C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)CC[C@]34C IC50 = 105000 nM Poor binder T33969 ATP-binding cassette transporter B11 D06YYD Dexlansoprazole Approved 9578005 C16H14F3N3O2S 369.4 CC1=C(C=CN=C1C[S@@](=O)C2=NC3=CC=CC=C3N2)OCC(F)(F)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D06ZII Eszopiclone Approved 969472 C17H17ClN6O3 388.8 CN1CCN(CC1)C(=O)O[C@H]2C3=NC=CN=C3C(=O)N2C4=NC=C(C=C4)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D06ZUK Imipramine Approved 3696 C19H24N2 280.4 CN(C)CCCN1C2=CC=CC=C2CCC3=CC=CC=C31 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07CWD Hydroxyurea Approved 3657 CH4N2O2 76.055 C(=O)(N)NO IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07GRH Ciclopirox Approved 2749 C12H17NO2 207.27 CC1=CC(=O)N(C(=C1)C2CCCCC2)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07HGR Lisinopril Approved 5362119 C21H31N3O5 405.5 C1C[C@H](N(C1)C(=O)[C@H](CCCCN)N[C@@H](CCC2=CC=CC=C2)C(=O)O)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07HVY Efavirenz Approved 64139 C14H9ClF3NO2 315.67 C1CC1C#C[C@]2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07IEF Bisacodyl Approved 2391 C22H19NO4 361.4 CC(=O)OC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC(=O)C)C3=CC=CC=N3 IC50 = 56360 nM Poor binder T33969 ATP-binding cassette transporter B11 D07JGT Nalidixic Acid Approved 4421 C12H12N2O3 232.23 CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07KSG Tamoxifen Approved 2733526 C26H29NO 371.5 CC/C(=C(\\C1=CC=CC=C1)/C2=CC=C(C=C2)OCCN(C)C)/C3=CC=CC=C3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07QCE Azathioprine Approved 2265 C9H7N7O2S 277.27 CN1C=NC(=C1SC2=NC=NC3=C2NC=N3)[N+](=O)[O-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07SUG Busulfan Approved 2478 C6H14O6S2 246.3 CS(=O)(=O)OCCCCOS(=O)(=O)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07TQV Lamivudine Approved 60825 C8H11N3O3S 229.26 C1[C@H](O[C@H](S1)CO)N2C=CC(=NC2=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07UYO Linezolid Approved 441401 C16H20FN3O4 337.35 CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCOCC3)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07VDZ Topiramate Approved 5284627 C12H21NO8S 339.36 CC1(O[C@@H]2CO[C@@]3([C@H]([C@@H]2O1)OC(O3)(C)C)COS(=O)(=O)N)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07VLY Doxorubicin Approved 31703 C27H29NO11 543.5 C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07WEP Diazoxide Approved 3019 C8H7ClN2O2S 230.67 CC1=NS(=O)(=O)C2=C(N1)C=CC(=C2)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07XSN Cytarabine Approved 6253 C9H13N3O5 243.22 C1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08EBN Nitazoxanide Approved 41684 C12H9N3O5S 307.28 CC(=O)OC1=CC=CC=C1C(=O)NC2=NC=C(S2)[N+](=O)[O-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08HVR Levodopa Approved 6047 C9H11NO4 197.19 C1=CC(=C(C=C1C[C@@H](C(=O)O)N)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08HZC Penicillamine Approved 5852 C5H11NO2S 149.21 CC(C)([C@H](C(=O)O)N)S IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08HZL Trimeprazine Approved 5574 C18H22N2S 298.4 CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C IC50 = 73720 nM Poor binder T33969 ATP-binding cassette transporter B11 D08JIV Amlodipine Approved 2162 C20H25ClN2O5 408.9 CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCN IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08PIQ Methylprednisolone Approved 6741 C22H30O5 374.5 C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)C=C4)C)O)C)(C(=O)CO)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08QMX Estradiol Approved 5757 C18H24O2 272.4 C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08ROP Leflunomide Approved 3899 C12H9F3N2O2 270.21 CC1=C(C=NO1)C(=O)NC2=CC=C(C=C2)C(F)(F)F IC50 = 110000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08USJ Neostigmine Approved 4456 C12H19N2O2+ 223.29 CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08VRO Ketanserin Approved 3822 C22H22FN3O3 395.4 C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCN3C(=O)C4=CC=CC=C4NC3=O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08VXL Molsidomine Approved 5353788 C9H14N4O4 242.23 CCO/C(=N/C1=C[N+](=NO1)N2CCOCC2)/[O-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08VXO Brompheniramine Approved 6834 C16H19BrN2 319.24 CN(C)CCC(C1=CC=C(C=C1)Br)C2=CC=CC=N2 IC50 ~ 100000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08VYV Metoclopramide Approved 4168 C14H22ClN3O2 299.79 CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC)N)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08ZEB Chlorzoxazone Approved 2733 C7H4ClNO2 169.56 C1=CC2=C(C=C1Cl)NC(=O)O2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09DWL Zaleplon Approved 5719 C17H15N5O 305.33 CCN(C1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)C#N)C(=O)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09EGZ Chloroquine Approved 2719 C18H26ClN3 319.9 CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09HVL Bivalirudin Approved 16129704 C98H138N24O33 2180.3 CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CC(=O)N)NC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H]4CCCN4C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]5CCCN5C(=O)[C@@H](CC6=CC=CC=C6)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09IOI Amoxapine Approved 2170 C17H16ClN3O 313.8 C1CN(CCN1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09JUG Zileuton Approved 60490 C11H12N2O2S 236.29 CC(C1=CC2=CC=CC=C2S1)N(C(=O)N)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09LNI Fluconazole Approved 3365 C13H12F2N6O 306.27 C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09LWS Ezetimibe Approved 150311 C24H21F2NO3 409.4 C1=CC(=CC=C1[C@@H]2[C@H](C(=O)N2C3=CC=C(C=C3)F)CC[C@@H](C4=CC=C(C=C4)F)O)O IC50 = 56000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09LZT Levomepromazine Approved 72287 C19H24N2OS 328.5 C[C@@H](CN1C2=CC=CC=C2SC3=C1C=C(C=C3)OC)CN(C)C IC50 = 127000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09MGR Etoricoxib Approved 123619 C18H15ClN2O2S 358.8 CC1=NC=C(C=C1)C2=C(C=C(C=N2)Cl)C3=CC=C(C=C3)S(=O)(=O)C IC50 = 53200 nM Poor binder T33969 ATP-binding cassette transporter B11 D09NIA Chlorthalidone Approved 2732 C14H11ClN2O4S 338.8 C1=CC=C2C(=C1)C(=O)NC2(C3=CC(=C(C=C3)Cl)S(=O)(=O)N)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09PNY Tropicamide Approved 5593 C17H20N2O2 284.35 CCN(CC1=CC=NC=C1)C(=O)C(CO)C2=CC=CC=C2 IC50 = 150900 nM Poor binder T33969 ATP-binding cassette transporter B11 D09TBD Sulfisoxazole Approved 5344 C11H13N3O3S 267.31 CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09UZO Mercaptopurine Approved 667490 C5H4N4S 152.18 C1=NC2=C(N1)C(=S)N=CN2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09XQF Isoniazid Approved 3767 C6H7N3O 137.14 C1=CN=CC=C1C(=O)NN IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0A2ZX Metronidazole Approved 4173 C6H9N3O3 171.15 CC1=NC=C(N1CCO)[N+](=O)[O-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0AD5C Acarbose Approved 41774 C25H43NO18 645.6 C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](OC([C@@H]([C@H]3O)O)O)CO)CO)O)O)N[C@H]4C=C([C@H]([C@@H]([C@H]4O)O)O)CO IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0AO5H Trimethoprim Approved 5578 C14H18N4O3 290.32 COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0AP9T Cefotetan Approved 53025 C17H17N7O8S4 575.6 CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@](C3=O)(NC(=O)C4SC(=C(C(=O)N)C(=O)O)S4)OC)SC2)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0AV3G Domperidone Approved 3151 C22H24ClN5O2 425.9 C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=O)CCCN4C5=CC=CC=C5NC4=O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0B1IP Etretinate Approved 5282375 C23H30O3 354.5 CCOC(=O)/C=C(\\C)/C=C/C=C(\\C)/C=C/C1=C(C(=C(C=C1C)OC)C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0B2UZ Prochlorperazine Approved 4917 C20H24ClN3S 373.9 CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0B4IF Ketoconazole Approved 3823 C26H28Cl2N4O4 531.4 CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OCC3COC(O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl IC50 = 65400 nM Poor binder T33969 ATP-binding cassette transporter B11 D0B5MP Aciclovir Approved 135398513 C8H11N5O3 225.2 C1=NC2=C(N1COCCO)N=C(NC2=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0B6TW Leucovorin Calcium Approved 135403647 C20H21CaN7O7 511.5 . IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0B7EB Etoposide Approved 36462 C29H32O13 588.6 C[C@@H]1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@@H](O2)O[C@H]3[C@H]4COC(=O)[C@@H]4[C@@H](C5=CC6=C(C=C35)OCO6)C7=CC(=C(C(=C7)OC)O)OC)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0B8UJ Nelarabine Approved 3011155 C11H15N5O5 297.27 COC1=NC(=NC2=C1N=CN2[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0B8WN Ranitidine Approved 3001055 C13H22N4O3S 314.41 CN/C(=C\\[N+](=O)[O-])/NCCSCC1=CC=C(O1)CN(C)C IC50 ~ 135000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0C1WH Letrozole Approved 3902 C17H11N5 285.3 C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)N3C=NC=N3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0C3YQ Mesna Approved 23662354 C2H5NaO3S2 164.18 C(CS(=O)(=O)[O-])S.[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0C8EU Temozolomide Approved 5394 C6H6N6O2 194.15 CN1C(=O)N2C=NC(=C2N=N1)C(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0CL9S Telbivudine Approved 159269 C10H14N2O5 242.23 CC1=CN(C(=O)NC1=O)[C@@H]2C[C@H]([C@@H](O2)CO)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0CS2F Loperamide Approved 3955 C29H33ClN2O2 477 CN(C)C(=O)C(CCN1CCC(CC1)(C2=CC=C(C=C2)Cl)O)(C3=CC=CC=C3)C4=CC=CC=C4 IC50 = 67000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0CT9C Cyclophosphamide Approved 2907 C7H15Cl2N2O2P 261.079 C1CNP(=O)(OC1)N(CCCl)CCCl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0CW1P Betamethasone Approved 9782 C22H29FO5 392.5 C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)F)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0D0ZD Miglitol Approved 441314 C8H17NO5 207.22 C1[C@@H]([C@H]([C@@H]([C@H](N1CCO)CO)O)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0D1AL Haloperidol Approved 3559 C21H23ClFNO2 375.9 C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC(=O)C3=CC=C(C=C3)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0D1SG Prednisolone Approved 5755 C21H28O5 360.4 C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)CCC4=CC(=O)C=C[C@]34C)O IC50 = 91470 nM Poor binder T33969 ATP-binding cassette transporter B11 D0D2VS Exemestane Approved 60198 C20H24O2 296.4 C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC(=C)C4=CC(=O)C=C[C@]34C IC50 = 90000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0D5GD Flumazenil Approved 3373 C15H14FN3O3 303.29 CCOC(=O)C1=C2CN(C(=O)C3=C(N2C=N1)C=CC(=C3)F)C IC50 ~ 100000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0D5GG Pemoline Approved 4723 C9H8N2O2 176.17 . IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0D7KC Alvimopan Approved 5488548 C25H32N2O4 424.5 C[C@H]1CN(CC[C@@]1(C)C2=CC(=CC=C2)O)C[C@H](CC3=CC=CC=C3)C(=O)NCC(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0DJ1B Naproxen Approved 156391 C14H14O3 230.26 C[C@@H](C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0E0SW Enoximone Approved 53708 C12H12N2O2S 248.3 CC1=C(NC(=O)N1)C(=O)C2=CC=C(C=C2)SC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0E1SW Acetazolamide Approved 1986 C4H6N4O3S2 222.3 CC(=O)NC1=NN=C(S1)S(=O)(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0E1XL Levetiracetam Approved 5284583 C8H14N2O2 170.21 CC[C@@H](C(=O)N)N1CCCC1=O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0E3OF Warfarin Approved 54678486 C19H16O4 308.3 CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O IC50 = 115300 nM Poor binder T33969 ATP-binding cassette transporter B11 D0E6YQ Tacrine Approved 1935 C13H14N2 198.26 C1CCC2=NC3=CC=CC=C3C(=C2C1)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0E7PQ Vorinostat Approved 5311 C14H20N2O3 264.32 C1=CC=C(C=C1)NC(=O)CCCCCCC(=O)NO IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0EG1I Tofacitinib Approved 9926791 C16H20N6O 312.37 C[C@@H]1CCN(C[C@@H]1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0EJ6O Ciprofibrate Approved 2763 C13H14Cl2O3 289.15 CC(C)(C(=O)O)OC1=CC=C(C=C1)C2CC2(Cl)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0F3SY Tegafur Approved 288216 C8H9FN2O3 200.17 C1C[C@@H](OC1)N2C=C(C(=O)NC2=O)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0F6EO Amoxicillin Approved 33613 C16H19N3O5S 365.4 CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=C(C=C3)O)N)C(=O)O)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0G4OD Tigecycline Approved 54686904 C29H39N5O8 585.6 . IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0G5AG Mizoribine Approved 104762 C9H13N3O6 259.22 C1=NC(=C(N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0G5QB Alfentanil Approved 51263 C21H32N6O3 416.5 CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCN3C(=O)N(N=N3)CC)COC IC50 ~ 135000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0G5UB Amlexanox Approved 2161 C16H14N2O4 298.29 CC(C)C1=CC2=C(C=C1)OC3=NC(=C(C=C3C2=O)C(=O)O)N IC50 = 104000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0G6CT Levonorgestrel Approved 13109 C21H28O2 312.4 CC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=O)CC[C@H]34 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0G7FJ Meloxicam Approved 54677470 C14H13N3O4S2 351.4 CC1=CN=C(S1)NC(=O)C2=C(C3=CC=CC=C3S(=O)(=O)N2C)O IC50 = 77500 nM Poor binder T33969 ATP-binding cassette transporter B11 D0G8NN Pramipexole Approved 119570 C10H17N3S 211.33 CCCN[C@H]1CCC2=C(C1)SC(=N2)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0G9YH Amsacrine Approved 2179 C21H19N3O3S 393.5 COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=CC3=NC4=CC=CC=C42 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0GU4K Aprepitant Approved 135413536 C23H21F7N4O3 534.4 . IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0GY5Z Aspirin Approved 2244 C9H8O4 180.16 CC(=O)OC1=CC=CC=C1C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0H0KB Riluzole Approved 5070 C8H5F3N2OS 234.2 C1=CC2=C(C=C1OC(F)(F)F)SC(=N2)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0H1YQ Xatral Approved 71764 C19H28ClN5O4 425.9 CN(CCCNC(=O)C1CCCO1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0H3HM Aripiprazole Approved 60795 C23H27Cl2N3O2 448.4 C1CC(=O)NC2=C1C=CC(=C2)OCCCCN3CCN(CC3)C4=C(C(=CC=C4)Cl)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0H3WI Ribavirin Approved 37542 C8H12N4O5 244.2 C1=NC(=NN1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)C(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0H6QU Apomorphine Approved 6005 C17H17NO2 267.32 CN1CCC2=C3[C@H]1CC4=C(C3=CC=C2)C(=C(C=C4)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0H8FH Indapamide Approved 3702 C16H16ClN3O3S 365.8 CC1CC2=CC=CC=C2N1NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0I0EG Captopril Approved 44093 C9H15NO3S 217.29 C[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0I2MK Metoprolol Approved 4171 C15H25NO3 267.36 CC(C)NCC(COC1=CC=C(C=C1)CCOC)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0I4DQ Alprostadil Approved 5280723 C20H34O5 354.5 CCCCC[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CCCCCCC(=O)O)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0I6IB Tenoxicam Approved 54677971 C13H11N3O4S2 337.4 . IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0I7SZ Quinapril Approved 54892 C25H30N2O5 438.5 CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CC3=CC=CC=C3C[C@H]2C(=O)O IC50 = 94000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0I8DD Dantrolene Approved 6914273 C14H10N4O5 314.25 C1C(=O)NC(=O)N1/N=C/C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-] IC50 = 145500 nM Poor binder T33969 ATP-binding cassette transporter B11 D0IT2X Carprofen Approved 2581 C15H12ClNO2 273.71 CC(C1=CC2=C(C=C1)C3=C(N2)C=CC(=C3)Cl)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0IX6I cortisone Approved 222786 C21H28O5 360.4 C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C IC50 = 108100 nM Poor binder T33969 ATP-binding cassette transporter B11 D0J1MI Mebendazole Approved 4030 C16H13N3O3 295.29 COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0J1VY Entacapone Approved 5281081 C14H15N3O5 305.29 CCN(CC)C(=O)/C(=C/C1=CC(=C(C(=C1)O)O)[N+](=O)[O-])/C#N IC50 = 55600 nM Poor binder T33969 ATP-binding cassette transporter B11 D0J2KV Propafenone Approved 4932 C21H27NO3 341.4 CCCNCC(COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)O IC50 = 53700 nM Poor binder T33969 ATP-binding cassette transporter B11 D0J2MJ Selegiline Hydrochloride Approved 26758 C13H18ClN 223.74 C[C@H](CC1=CC=CC=C1)N(C)CC#C.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0J5DC Clofibrate Approved 2796 C12H15ClO3 242.7 CCOC(=O)C(C)(C)OC1=CC=C(C=C1)Cl IC50 = 60000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0J7RK Dobutamine Approved 36811 C18H23NO3 301.4 CC(CCC1=CC=C(C=C1)O)NCCC2=CC(=C(C=C2)O)O IC50 ~ 100000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0J9XZ Torasemide Approved 41781 C16H20N4O3S 348.4 CC1=CC(=CC=C1)NC2=C(C=NC=C2)S(=O)(=O)NC(=O)NC(C)C IC50 = 130700 nM Poor binder T33969 ATP-binding cassette transporter B11 D0JO7Y Fulvestrant Approved 104741 C32H47F5O3S 606.8 C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)[C@@H](CC4=C3C=CC(=C4)O)CCCCCCCCCS(=O)CCCC(C(F)(F)F)(F)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0K0OZ Famotidine Approved 5702160 C8H15N7O2S3 337.5 C1=C(N=C(S1)N=C(N)N)CSCC/C(=N/S(=O)(=O)N)/N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0K0VO Urapidil Approved 5639 C20H29N5O3 387.5 CN1C(=CC(=O)N(C1=O)C)NCCCN2CCN(CC2)C3=CC=CC=C3OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0K3MC Lofepramine Approved 3947 C26H27ClN2O 419 CN(CCCN1C2=CC=CC=C2CCC3=CC=CC=C31)CC(=O)C4=CC=C(C=C4)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0K5CB Salbutamol Approved 2083 C13H21NO3 239.31 CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0K6GZ Sparfloxacin Approved 60464 C19H22F2N4O3 392.4 C[C@@H]1CN(C[C@@H](N1)C)C2=C(C(=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)N)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0K7HU Ciclesonide Approved 6918155 C32H44O7 540.7 CC(C)C(=O)OCC(=O)[C@@]12[C@@H](C[C@@H]3[C@@]1(C[C@@H]([C@H]4[C@H]3CCC5=CC(=O)C=C[C@]45C)O)C)O[C@H](O2)C6CCCCC6 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0K7WK Ondansetron Approved 4595 C18H19N3O 293.4 CC1=NC=CN1CC2CCC3=C(C2=O)C4=CC=CC=C4N3C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0KR2J Entecavir Approved 135398508 C12H15N5O3 277.28 . IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0L2MX Benzthiazide Approved 2343 C15H14ClN3O4S3 431.9 C1=CC=C(C=C1)CSCC2=NS(=O)(=O)C3=CC(=C(C=C3N2)Cl)S(=O)(=O)N IC50 = 57430 nM Poor binder T33969 ATP-binding cassette transporter B11 D0L3DK Vildagliptin Approved 6918537 C17H25N3O2 303.4 C1C[C@H](N(C1)C(=O)CNC23CC4CC(C2)CC(C4)(C3)O)C#N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0L5RW Plerixafor Approved 65015 C28H54N8 502.8 C1CNCCNCCCN(CCNC1)CC2=CC=C(C=C2)CN3CCCNCCNCCCNCC3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0L6DA Valdecoxib Approved 119607 C16H14N2O3S 314.4 CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0L7FM Probenecid Approved 4911 C13H19NO4S 285.36 CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0L9ZR Praziquantel Approved 4891 C19H24N2O2 312.4 C1CCC(CC1)C(=O)N2CC3C4=CC=CC=C4CCN3C(=O)C2 IC50 = 60270 nM Poor binder T33969 ATP-binding cassette transporter B11 D0M2MR Gliclazide Approved 3475 C15H21N3O3S 323.4 CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NN2CC3CCCC3C2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0M4YC Disopyramide Approved 3114 C21H29N3O 339.5 CC(C)N(CCC(C1=CC=CC=C1)(C2=CC=CC=N2)C(=O)N)C(C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0M5JI Luvox Approved 9560989 C19H25F3N2O6 434.4 COCCCC/C(=N\\OCCN)/C1=CC=C(C=C1)C(F)(F)F.C(=C\\C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0M5OC Trandolapril Approved 5484727 C24H34N2O5 430.5 CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2[C@H]3CCCC[C@@H]3C[C@H]2C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0M6DO Aminoglutethimide Approved 2145 C13H16N2O2 232.28 CCC1(CCC(=O)NC1=O)C2=CC=C(C=C2)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0M8RC Terbutaline Approved 5403 C12H19NO3 225.28 CC(C)(C)NCC(C1=CC(=CC(=C1)O)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0M9DC Oxaprozin Approved 4614 C18H15NO3 293.3 C1=CC=C(C=C1)C2=C(OC(=N2)CCC(=O)O)C3=CC=CC=C3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0MA9N Dapsone Approved 2955 C12H12N2O2S 248.3 C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0N0RU Bexarotene Approved 82146 C24H28O2 348.5 CC1=CC2=C(C=C1C(=C)C3=CC=C(C=C3)C(=O)O)C(CCC2(C)C)(C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0N3VR Voriconazole Approved 71616 C16H14F3N5O 349.31 C[C@@H](C1=NC=NC=C1F)[C@](CN2C=NC=N2)(C3=C(C=C(C=C3)F)F)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0N4OW Vasopressin Approved 644077 C46H65N15O12S2 1084.2 C1C[C@H](N(C1)C(=O)[C@@H]2CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2)CC(=O)N)CCC(=O)N)CC3=CC=CC=C3)CC4=CC=C(C=C4)O)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0N5HJ Enalaprilat Approved 5462501 C18H24N2O5 348.4 C[C@@H](C(=O)N1CCC[C@H]1C(=O)O)N[C@@H](CCC2=CC=CC=C2)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0NG7O Zolmitriptan Approved 60857 C16H21N3O2 287.36 CN(C)CCC1=CNC2=C1C=C(C=C2)C[C@H]3COC(=O)N3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0NJ3V Papaverine Approved 4680 C20H21NO4 339.4 COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0NR6S Maraviroc Approved 3002977 C29H41F2N5O 513.7 CC1=NN=C(N1C2C[C@H]3CC[C@@H](C2)N3CC[C@@H](C4=CC=CC=C4)NC(=O)C5CCC(CC5)(F)F)C(C)C IC50 = 110000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0NS6H Donepezil Approved 3152 C24H29NO3 379.5 COC1=C(C=C2C(=C1)CC(C2=O)CC3CCN(CC3)CC4=CC=CC=C4)OC IC50 = 78000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0NW3X Dofetilide Approved 71329 C19H27N3O5S2 441.6 CN(CCC1=CC=C(C=C1)NS(=O)(=O)C)CCOC2=CC=C(C=C2)NS(=O)(=O)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0O1WX Ciprofloxacin XR Approved 2764 C17H18FN3O3 331.34 C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCNCC4)F)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0O2EM Nevirapine Approved 4463 C15H14N4O 266.3 CC1=C2C(=NC=C1)N(C3=C(C=CC=N3)C(=O)N2)C4CC4 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0O2SR Nicorandil Approved 47528 C8H9N3O4 211.17 C1=CC(=CN=C1)C(=O)NCCO[N+](=O)[O-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0O4SE Tindamax Approved 5479 C8H13N3O4S 247.27 CCS(=O)(=O)CCN1C(=NC=C1[N+](=O)[O-])C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0O5FY Meropenem Approved 441130 C17H25N3O5S 383.5 C[C@@H]1[C@@H]2[C@H](C(=O)N2C(=C1S[C@H]3C[C@H](NC3)C(=O)N(C)C)C(=O)O)[C@@H](C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0O6SX Hydroxyzine Approved 3658 C21H27ClN2O2 374.9 C1CN(CCN1CCOCCO)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl IC50 = 72910 nM Poor binder T33969 ATP-binding cassette transporter B11 D0OB1J Diltiazem Approved 39186 C22H26N2O4S 414.5 CC(=O)O[C@@H]1[C@@H](SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0OT0O Foscavir Approved 44561 CNa3O5P 191.95 C(=O)([O-])P(=O)([O-])[O-].[Na+].[Na+].[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0P0HT Fluorometholone Approved 9878 C22H29FO4 376.5 C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@]2([C@@]4(C1=CC(=O)C=C4)C)F)O)C)(C(=O)C)O IC50 = 100900 nM Poor binder T33969 ATP-binding cassette transporter B11 D0P1UX Venlafaxine Approved 5656 C17H27NO2 277.4 CN(C)CC(C1=CC=C(C=C1)OC)C2(CCCCC2)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0P7JZ Carbidopa Approved 34359 C10H14N2O4 226.23 C[C@](CC1=CC(=C(C=C1)O)O)(C(=O)O)NN IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0P9RF Terazosin Approved 5401 C19H25N5O4 387.4 COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4CCCO4)N)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0PQ3G Furosemide Approved 3440 C12H11ClN2O5S 330.74 C1=COC(=C1)CNC2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0PW7C Cefaclor Approved 51039 C15H14ClN3O4S 367.8 C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)C(=O)O)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Q0RC Ethopropazine Approved 3290 C19H24N2S 312.5 CCN(CC)C(C)CN1C2=CC=CC=C2SC3=CC=CC=C31 IC50 = 139200 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Q2PE Norfloxacin Approved 4539 C16H18FN3O3 319.33 CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCNCC3)F)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Q4XQ Ethosuximide Approved 3291 C7H11NO2 141.17 CCC1(CC(=O)NC1=O)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Q4YK Piracetam Approved 4843 C6H10N2O2 142.16 C1CC(=O)N(C1)CC(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Q5UQ Exjade Approved 214348 C21H15N3O4 373.4 . IC50 = 58400 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Q8ZX Benzocaine Approved 2337 C9H11NO2 165.19 CCOC(=O)C1=CC=C(C=C1)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0QL3P Oxcarbazepine Approved 34312 C15H12N2O2 252.27 C1C2=CC=CC=C2N(C3=CC=CC=C3C1=O)C(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R0BX Nitrofurantoin Approved 6604200 C8H6N4O5 238.16 C1C(=O)NC(=O)N1/N=C/C2=CC=C(O2)[N+](=O)[O-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R0FE Verapamil Approved 2520 C27H38N2O4 454.6 CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC IC50 = 79100 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R1QE Ibuprofen Approved 3672 C13H18O2 206.28 CC(C)CC1=CC=C(C=C1)C(C)C(=O)O IC50 ~ 135000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R1WR Procyclidine Approved 4919 C19H29NO 287.4 C1CCC(CC1)C(CCN2CCCC2)(C3=CC=CC=C3)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R2KJ Dicloxacillin Approved 18381 C19H17Cl2N3O5S 470.3 CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O IC50 = 56400 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R2KY Ethynodiol Diacetate Approved 9270 C24H32O4 384.5 CC(=O)O[C@H]1CC[C@@H]2[C@H]3CC[C@]4([C@H]([C@@H]3CCC2=C1)CC[C@]4(C#C)OC(=O)C)C IC50 = 62000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R3FP Tenofovir disoproxil fumarate Approved 6398764 C23H34N5O14P 635.5 C[C@H](CN1C=NC2=C(N=CN=C21)N)OCP(=O)(OCOC(=O)OC(C)C)OCOC(=O)OC(C)C.C(=C/C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R3QY Vigabatrin Approved 5665 C6H11NO2 129.16 C=CC(CCC(=O)O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R5RR Clofarabine Approved 119182 C10H11ClFN5O3 303.68 C1=NC2=C(N=C(N=C2N1[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)F)Cl)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R6TI Inamrinone Lactate Approved 3698 C10H9N3O 187.2 C1=CN=CC=C1C2=CNC(=O)C(=C2)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R7HO Bumetanide Approved 2471 C17H20N2O5S 364.4 CCCCNC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N)OC2=CC=CC=C2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R8ER Enoxacin Approved 3229 C15H17FN4O3 320.32 CCN1C=C(C(=O)C2=CC(=C(N=C21)N3CCNCC3)F)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R9OH Sulfamethoxazole Approved 5329 C10H11N3O3S 253.28 CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R9VR Galantamine Approved 9651 C17H21NO3 287.35 CN1CC[C@@]23C=C[C@@H](C[C@@H]2OC4=C(C=CC(=C34)C1)OC)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0RG3O Atropine Approved 174174 C17H23NO3 289.4 CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3 IC50 ~ 135000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0S0AS Ipratropium Approved 3746 C20H30NO3+ 332.5 CC(C)[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0S1NZ Acipimox Approved 5310993 C6H6N2O3 154.12 CC1=CN=C(C=[N+]1[O-])C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0S4BR Methimazole Approved 1349907 C4H6N2S 114.17 CN1C=CNC1=S IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0S5WG Flucytosine Approved 3366 C4H4FN3O 129.09 C1=NC(=O)NC(=C1F)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0S9MC Clobazam - Lundbeck Approved 2789 C16H13ClN2O2 300.74 CN1C(=O)CC(=O)N(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0S9SD Emtricitabine Approved 60877 C8H10FN3O3S 247.25 C1[C@H](O[C@H](S1)CO)N2C=C(C(=NC2=O)N)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0SH3I Bortezomib Approved 387447 C19H25BN4O4 384.2 B([C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=NC=CN=C2)(O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0SV8E Methotrexate Approved 126941 C20H22N8O5 454.4 CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0T1LK Primaquine Approved 4908 C15H21N3O 259.35 CC(CCCN)NC1=C2C(=CC(=C1)OC)C=CC=N2 IC50 = 53120 nM Poor binder T33969 ATP-binding cassette transporter B11 D0T2XU Promethazine Approved 4927 C17H20N2S 284.4 CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)N(C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0T3AD Pentostatin Approved 439693 C11H16N4O4 268.27 C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC=NC[C@H]3O)CO)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0T3NY Crotamiton Approved 688020 C13H17NO 203.28 CCN(C1=CC=CC=C1C)C(=O)/C=C/C IC50 = 109500 nM Poor binder T33969 ATP-binding cassette transporter B11 D0T5WK Nitrazepam Approved 4506 C15H11N3O3 281.27 C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0T7US Eprosartan Approved 5281037 C23H24N2O4S 424.5 CCCCC1=NC=C(N1CC2=CC=C(C=C2)C(=O)O)/C=C(\\CC3=CC=CS3)/C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0T8GD Nicotine Approved 89594 C10H14N2 162.23 CN1CCC[C@H]1C2=CN=CC=C2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0T8VY Aceclofenac Approved 71771 C16H13Cl2NO4 354.2 C1=CC=C(C(=C1)CC(=O)OCC(=O)O)NC2=C(C=CC=C2Cl)Cl IC50 = 105000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0T9DT Diatrizoate Approved 2140 C11H9I3N2O4 613.91 CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)NC(=O)C)I IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0T9TJ Orlistat Approved 3034010 C29H53NO5 495.7 CCCCCCCCCCC[C@@H](C[C@H]1[C@@H](C(=O)O1)CCCCCC)OC(=O)[C@H](CC(C)C)NC=O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0TG1H Diclofenac Approved 3033 C14H11Cl2NO2 296.1 C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)Cl IC50 = 64970 nM Poor binder T33969 ATP-binding cassette transporter B11 D0U0KW Ramelteon Approved 208902 C16H21NO2 259.339 CCC(=O)NCC[C@@H]1CCC2=C1C3=C(C=C2)OCC3 IC50 = 85000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0U1OM Bromfenac Approved 60726 C15H12BrNO3 334.16 C1=CC(=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)N)CC(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0U2JP Sitagliptin Approved 4369359 C16H15F6N5O 407.31 C1CN2C(=NN=C2C(F)(F)F)CN1C(=O)C[C@@H](CC3=CC(=C(C=C3F)F)F)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0U2OO Buspirone Approved 2477 C21H31N5O2 385.5 C1CCC2(C1)CC(=O)N(C(=O)C2)CCCCN3CCN(CC3)C4=NC=CC=N4 IC50 = 59630 nM Poor binder T33969 ATP-binding cassette transporter B11 D0U4UQ Hydrochlorothiazide Approved 3639 C7H8ClN3O4S2 297.7 C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0U5QK Acetaminophen Approved 1983 C8H9NO2 151.16 CC(=O)NC1=CC=C(C=C1)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0U5RT Primidone Approved 4909 C12H14N2O2 218.25 CCC1(C(=O)NCNC1=O)C2=CC=CC=C2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0U5SI Procainamide Approved 4913 C13H21N3O 235.33 CCN(CC)CCNC(=O)C1=CC=C(C=C1)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0UF6M Thiacetazone Approved 9568512 C10H12N4OS 236.3 CC(=O)NC1=CC=C(C=C1)/C=N/NC(=S)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0UM7O Ketamine Approved 3821 C13H16ClNO 237.72 CNC1(CCCCC1=O)C2=CC=CC=C2Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0V4QS Olanzapine Approved 135398745 C17H20N4S 312.4 . IC50 = 54570 nM Poor binder T33969 ATP-binding cassette transporter B11 D0V8QT Chlorambucil Approved 2708 C14H19Cl2NO2 304.2 C1=CC(=CC=C1CCCC(=O)O)N(CCCl)CCCl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0V9BD Bicalutamide Approved 2375 C18H14F4N2O4S 430.4 CC(CS(=O)(=O)C1=CC=C(C=C1)F)(C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)O IC50 = 79600 nM Poor binder T33969 ATP-binding cassette transporter B11 D0V9OZ Sulphasalazine Approved 5339 C18H14N4O5S 398.4 . IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0VM2L Zoledronate Approved 68740 C5H10N2O7P2 272.09 C1=CN(C=N1)CC(O)(P(=O)(O)O)P(=O)(O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0VP1V Aclidinium Approved 11434515 C26H30NO4S2+ 484.7 C1C[N+]2(CCC1[C@H](C2)OC(=O)C(C3=CC=CS3)(C4=CC=CS4)O)CCCOC5=CC=CC=C5 IC50 = 127100 nM Poor binder T33969 ATP-binding cassette transporter B11 D0VT8P Famciclovir Approved 3324 C14H19N5O4 321.33 CC(=O)OCC(CCN1C=NC2=CN=C(N=C21)N)COC(=O)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0W0BF Anastrozole Approved 2187 C17H19N5 293.4 CC(C)(C#N)C1=CC(=CC(=C1)CN2C=NC=N2)C(C)(C)C#N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0W9LX Carvedilol Approved 2585 C24H26N2O4 406.5 COC1=CC=CC=C1OCCNCC(COC2=CC=CC3=C2C4=CC=CC=C4N3)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0W9MM Vinblastine Approved 13342 C46H58N4O9 811 CC[C@@]1(C[C@H]2C[C@@](C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC)O IC50 = 62000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0WE3O Morphine Approved 5288826 C17H19NO3 285.34 CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O IC50 ~ 135000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0WN0U Felodipine Approved 3333 C18H19Cl2NO4 384.2 CCOC(=O)C1=C(NC(=C(C1C2=C(C(=CC=C2)Cl)Cl)C(=O)OC)C)C IC50 = 69700 nM Poor binder T33969 ATP-binding cassette transporter B11 D0WS1X Cefdinir Approved 6915944 C14H13N5O5S2 395.4 C=CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)/C(=N\\O)/C3=CSC(=N3)N)SC1)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0X0RI Mexiletine Approved 4178 C11H17NO 179.26 CC1=C(C(=CC=C1)C)OCC(C)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0X2DK Phenoxybenzamine Approved 4768 C18H22ClNO 303.8 CC(COC1=CC=CC=C1)N(CCCl)CC2=CC=CC=C2 IC50 ~ 100000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0X4RN Lidocaine Approved 3676 C14H22N2O 234.34 CCN(CC)CC(=O)NC1=C(C=CC=C1C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0X5SD Disulfiram Approved 3117 C10H20N2S4 296.5 CCN(CC)C(=S)SSC(=S)N(CC)CC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0X5XU Decitabine Approved 451668 C8H12N4O4 228.21 C1[C@@H]([C@H](O[C@H]1N2C=NC(=NC2=O)N)CO)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0X6IU Chloramphenicol Approved 5959 C11H12Cl2N2O5 323.13 C1=CC(=CC=C1[C@H]([C@@H](CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0X9RG Butorphanol Approved 5361092 C21H29NO2 327.5 C1CC[C@]2([C@H]3CC4=C([C@]2(C1)CCN3CC5CCC5)C=C(C=C4)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0X9ZC Cefadroxil Approved 47965 C16H17N3O5S 363.4 CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](C3=CC=C(C=C3)O)N)SC1)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0XF8W Pyrazinamide Approved 1046 C5H5N3O 123.11 C1=CN=C(C=N1)C(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y0SW Flutamide Approved 3397 C11H11F3N2O3 276.21 CC(C)C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F IC50 = 50000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y2CJ Minoxidil Approved 4201 C9H15N5O 209.25 C1CCN(CC1)C2=NC(=N)N(C(=C2)N)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y2YP Flurandrenolide Approved 15209 C24H33FO6 436.5 C[C@]12CCC(=O)C=C1[C@H](C[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3C[C@@H]5[C@]4(OC(O5)(C)C)C(=O)CO)C)O)F IC50 = 71190 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y3MO Amikacin Approved 37768 C22H43N5O13 585.6 C1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1NC(=O)[C@H](CCN)O)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)N)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y5UG Amitriptyline Approved 2160 C20H23N 277.4 CN(C)CCC=C1C2=CC=CC=C2CCC3=CC=CC=C31 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y7EM Felbinac Approved 3332 C14H12O2 212.24 C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y7PG Tolcapone Approved 4659569 C14H11NO5 273.24 CC1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-] IC50 = 119600 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y7RW Phenobarbital Approved 4763 C12H12N2O3 232.23 CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2 IC50 ~ 135000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y7ZU Dacarbazine Approved 135398738 C6H10N6O 182.18 . IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y9LL Lorcainide Approved 42884 C22H27ClN2O 370.9 CC(C)N1CCC(CC1)N(C2=CC=C(C=C2)Cl)C(=O)CC3=CC=CC=C3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Z1RV Clozapine Approved 135398737 C18H19ClN4 326.8 . IC50 = 75140 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Z4SB Glipizide Approved 3478 C21H27N5O4S 445.5 CC1=CN=C(C=N1)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Z5IU Sulindac Approved 1548887 C20H17FO3S 356.4 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)S(=O)C)C=CC(=C2)F)CC(=O)O IC50 = 63690 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Z6UC Sumatriptan Approved 5358 C14H21N3O2S 295.4 CNS(=O)(=O)CC1=CC2=C(C=C1)NC=C2CCN(C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Z8EX Stavudine Approved 18283 C10H12N2O4 224.21 CC1=CN(C(=O)NC1=O)[C@H]2C=C[C@H](O2)CO IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Z9QR Zalcitabine Approved 24066 C9H13N3O3 211.22 C1C[C@@H](O[C@@H]1CO)N2C=CC(=NC2=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0ZB7K Zopiclone Approved 5735 C17H17ClN6O3 388.8 CN1CCN(CC1)C(=O)OC2C3=NC=CN=C3C(=O)N2C4=NC=C(C=C4)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0ZS8P Clomipramine Approved 2801 C19H23ClN2 314.9 CN(C)CCCN1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0D8XY ATOSIBAN Phase 4 5311010 C43H67N11O12S2 994.2 CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSCCC(=O)N[C@@H](C(=O)N1)CC2=CC=C(C=C2)OCC)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN)C(=O)NCC(=O)N)CC(=O)N)[C@@H](C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0FT4R Sivelestat Phase 4 107706 C20H22N2O7S 434.5 CC(C)(C)C(=O)OC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NCC(=O)O IC50 = 142200 nM Poor binder T33969 ATP-binding cassette transporter B11 D0N1FS Diacerein Phase 4 26248 C19H12O8 368.3 CC(=O)OC1=CC=CC2=C1C(=O)C3=C(C2=O)C=C(C=C3OC(=O)C)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00GEG Ralfinamide Phase 3 5745207 C17H19FN2O2 302.34 C[C@@H](C(=O)N)NCC1=CC=C(C=C1)OCC2=CC=CC=C2F IC50 = 174700 nM Poor binder T33969 ATP-binding cassette transporter B11 D02OJC Xaliproden Phase 3 128919 C24H22F3N 381.4 C1CN(CC=C1C2=CC(=CC=C2)C(F)(F)F)CCC3=CC4=CC=CC=C4C=C3 IC50 = 117100 nM Poor binder T33969 ATP-binding cassette transporter B11 D07WCB Colchicine Phase 3 6167 C22H25NO6 399.4 CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09YDM Camptothecin Phase 3 24360 C20H16N2O4 348.4 CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0DV8K Dexamethasone Phase 3 5743 C22H29FO5 392.5 C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)F)C IC50 = 101700 nM Poor binder T33969 ATP-binding cassette transporter B11 D0E6FS Rivaroxaban Phase 3 9875401 C19H18ClN3O5S 435.9 C1COCC(=O)N1C2=CC=C(C=C2)N3C[C@@H](OC3=O)CNC(=O)C4=CC=C(S4)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0EO8K Valsartan Phase 3 60846 C24H29N5O3 435.5 CCCCC(=O)N(CC1=CC=C(C=C1)C2=CC=CC=C2C3=NNN=N3)[C@@H](C(C)C)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0F7XT Fluoxetine Phase 3 3386 C17H18F3NO 309.33 CNCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0J7KR Lenalidomide Phase 3 216326 C13H13N3O3 259.26 C1CC(=O)NC(=O)C1N2CC3=C(C2=O)C=CC=C3N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0X8ED Benserazide Phase 3 2327 C10H15N3O5 257.24 C1=CC(=C(C(=C1CNNC(=O)C(CO)N)O)O)O IC50 = 116600 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y1FO Rubitecan Phase 3 472335 C20H15N3O6 393.3 CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=C(C=CC=C5[N+](=O)[O-])N=C4C3=C2)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0G6XU Melatonin Phase 2/3 896 C13H16N2O2 232.28 CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0GC5H Ramatroban Phase 2/3 123879 C21H21FN2O4S 416.5 C1CC2=C(C[C@@H]1NS(=O)(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4N2CCC(=O)O IC50 = 62400 nM Poor binder T33969 ATP-binding cassette transporter B11 D04XYL 2'3'-Dideoxyinosine Phase 2 135398739 C10H12N4O3 236.23 . IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0DL8A Clarithromycin Phase 2 84029 C38H69NO13 748 CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)OC)C)C)O)(C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0ED3R Clopidogrel Phase 2 60606 C16H16ClNO2S 321.8 COC(=O)[C@H](C1=CC=CC=C1Cl)N2CCC3=C(C2)C=CS3 IC50 = 72000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0G0DZ Prazosin Phase 2 4893 C19H21N5O4 383.4 COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=CC=CO4)N)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0S4SX K-134 Phase 2 130313 C8H11NO5S 233.24 CC1([C@@H](N2[C@H](S1(=O)=O)CC2=O)C(=O)O)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Q7QY SSR-125047 Phase 1 53359 C16H14F3NO3S 357.3 CN(CC(=O)O)C(=S)C1=CC=CC2=C1C=CC(=C2C(F)(F)F)OC IC50 = 185300 nM Poor binder T33969 ATP-binding cassette transporter B11 D0TO2R Fludarabine phosphate Phase 1 30751 C10H13FN5O7P 365.21 C1=NC2=C(N=C(N=C2N1[C@H]3[C@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)F)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0S6TK tamatinib Clinical trial 11213558 C22H23FN6O5 470.5 CC1(C(=O)NC2=C(O1)C=CC(=N2)NC3=NC(=NC=C3F)NC4=CC(=C(C(=C4)OC)OC)OC)C IC50 = 196600 nM Poor binder T33969 ATP-binding cassette transporter B11 D03XTA PMID28870136-Compound-49 Patented 4740 C13H18N4O3 278.31 CC(=O)CCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08VAT Undecylenic acid derivative 1 Patented 5634 C11H20O2 184.27 C=CCCCCCCCCC(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0DF2M PMID28870136-Compound-48 Patented 2153 C7H8N4O2 180.16 CN1C2=C(C(=O)N(C1=O)C)NC=N2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0E2AD PMID27336223-Compound-10 Patented 5381 C21H21NO2S 351.5 CCOC(=O)C1=CN=C(C=C1)C#CC2=CC3=C(C=C2)SCCC3(C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0H9IX PMID28870136-Compound-52 Patented 2519 C8H10N4O2 194.19 CN1C=NC2=C1C(=O)N(C(=O)N2C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0KP0U PMID26394986-Compound-22 Patented 2662 C17H14F3N3O2S 381.4 CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0N9DS PMID27607364-Compound-4 Patented 3016 C16H13ClN2O 284.74 CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0R6LF Citalopram derivative 1 Patented 2771 C20H21FN2O 324.4 CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0W8JK PMID27336223-Compound-11 Patented 60164 C28H28O3 412.5 COC1=C(C=C(C=C1)C2=CC3=C(C=C2)C=C(C=C3)C(=O)O)C45CC6CC(C4)CC(C6)C5 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y3DN Flavonoid derivative 4 Patented 5280343 C15H10O7 302.23 C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00CCI Benoxaprofen Withdrawn from market 39941 C16H12ClNO3 301.72 CC(C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)Cl)C(=O)O IC50 = 103700 nM Poor binder T33969 ATP-binding cassette transporter B11 D01PIL Remoxipride Withdrawn from market 54477 C16H23BrN2O3 371.27 CCN1CCC[C@H]1CNC(=O)C2=C(C=CC(=C2OC)Br)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01VAB Alprenolol Withdrawn from market 2119 C15H23NO2 249.35 CC(C)NCC(COC1=CC=CC=C1CC=C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D02LHR INDORAMIN Withdrawn from market 33625 C22H25N3O 347.5 C1CN(CCC1NC(=O)C2=CC=CC=C2)CCC3=CNC4=CC=CC=C43 IC50 = 109000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03JPH Isoxicam Withdrawn from market 54677972 C14H13N3O5S 335.34 CC1=CC(=NO1)NC(=O)C2=C(C3=CC=CC=C3S(=O)(=O)N2C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D05RUM Melperone Withdrawn from market 15387 C16H22FNO 263.35 CC1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D06ABW CLIOQUINOL Withdrawn from market 2788 C9H5ClINO 305.5 C1=CC2=C(C(=C(C=C2Cl)I)O)N=C1 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07XPE Phenformin Withdrawn from market 8249 C10H15N5 205.26 C1=CC=C(C=C1)CCN=C(N)N=C(N)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08SOF Terfenadine Withdrawn from market 5405 C32H41NO2 471.7 CC(C)(C)C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0C0JT Nimesulide Withdrawn from market 4495 C13H12N2O5S 308.31 CS(=O)(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC2=CC=CC=C2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0O2IE Phenacetin Withdrawn from market 4754 C10H13NO2 179.22 CCOC1=CC=C(C=C1)NC(=O)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0OS6O Sertindole Withdrawn from market 60149 C24H26ClFN4O 440.9 C1CN(CCC1C2=CN(C3=C2C=C(C=C3)Cl)C4=CC=C(C=C4)F)CCN5CCNC5=O IC50 = 82700 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y2HR Astemizole Withdrawn from market 2247 C28H31FN4O 458.6 COC1=CC=C(C=C1)CCN2CCC(CC2)NC3=NC4=CC=CC=C4N3CC5=CC=C(C=C5)F IC50 = 58800 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y4FL Roxithromycin Withdrawn from market 6915744 C41H76N2O15 837 CC[C@@H]1[C@@]([C@@H]([C@H](/C(=N/OCOCCOC)/[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Y8UB Agomelatine Withdrawn from market 82148 C15H17NO2 243.3 CC(=O)NCCC1=CC=CC2=C1C=C(C=C2)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D04BQR Acecainide Discontinued in Phase 3 4342 C15H23N3O2 277.36 CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0S6QR BMS-204352 Discontinued in Phase 3 214350 C16H10ClF4NO2 359.7 COC1=C(C=C(C=C1)Cl)[C@]2(C3=C(C=C(C=C3)C(F)(F)F)NC2=O)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0Z0CH Almokalant Discontinued in Phase 3 3033962 C18H28N2O3S 352.5 CCCS(=O)CCCN(CC)CC(COC1=CC=C(C=C1)C#N)O IC50 = 55750 nM Poor binder T33969 ATP-binding cassette transporter B11 D0G9ZW Roquinimex Discontinued in Phase 1 54676478 C18H16N2O3 308.3 CN1C2=CC=CC=C2C(=C(C1=O)C(=O)N(C)C3=CC=CC=C3)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B04GRD Rasagiline mesylate Investigative 3052775 C13H17NO3S 267.35 CS(=O)(=O)O.C#CCN[C@@H]1CCC2=CC=CC=C12 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B0F6DY CID 137648451 Investigative 137648451 C206H305N51O66 4552 CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC5=CNC6=CC=CC=C65)C(=O)N[C@@H](CC7=CC=CC=C7)C(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC8=CN=CN8)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC9=CC=C(C=C9)O)NC(=O)C.CC(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B0WJL2 (3S)-3-[[(2S)-4-Amino-2-[[(2S)-2-(decanoylamino)-3-(1H-indol-3-yl)propanoyl]amino]-4-oxobutanoyl]amino]-4-[[(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-[2-(2-aminophenyl)-2-oxoethyl]-24-(3-aminopropyl)-15,21-bis(carboxymethyl)-6-[(2S)-1-carboxypropan-2-yl]-9-(hydroxymethyl)-18,31-dimethyl-2,5,8,11,14,17,20,23,26,29-decaoxo-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacont-30-yl]amino]-4-oxobutanoic acid Investigative 25246315 C72H101N17O26 1620.7 CCCCCCCCCC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]3[C@H](OC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC3=O)CCCN)CC(=O)O)C)CC(=O)O)CO)[C@@H](C)CC(=O)O)CC(=O)C4=CC=CC=C4N)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B18HYR Pindolol Investigative 4828 C14H20N2O2 248.32 CC(C)NCC(COC1=CC=CC2=C1C=CN2)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B18QDH Seroquel Investigative 5281025 C46H54N6O8S2 883.1 C1CN(CCN1CCOCCO)C2=NC3=CC=CC=C3SC4=CC=CC=C42.C1CN(CCN1CCOCCO)C2=NC3=CC=CC=C3SC4=CC=CC=C42.C(=C/C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B1BX8V N-(1-Adamantylmethyl)-5-[3-[[(2R)-1-hydroxypropan-2-yl]amino]propyl]-2-methylbenzamide Investigative 137642766 C25H38N2O2 398.6 CC1=C(C=C(C=C1)CCCN[C@H](C)CO)C(=O)NCC23CC4CC(C2)CC(C4)C3 IC50 = 65560 nM Poor binder T33969 ATP-binding cassette transporter B11 B1CSH5 Spiramycin Investigative 5289394 C43H74N2O14 843.1 C[C@@H]1C/C=C/C=C/[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)O)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)O)(C)O)N(C)C)O)CC=O)C)O[C@H]4CC[C@@H]([C@H](O4)C)N(C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B1IL2S Miconazole nitrate Investigative 68553 C18H15Cl4N3O4 479.1 C1=CC(=C(C=C1Cl)Cl)COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl.[N+](=O)(O)[O-] IC50 = 114000 nM Poor binder T33969 ATP-binding cassette transporter B11 B1JAC2 Bisoprolol fumarate Investigative 6917733 C22H35NO8 441.5 CC(C)NCC(COC1=CC=C(C=C1)COCCOC(C)C)O.C(=C/C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B1O0UE 2-(6-Hydroxy-3-oxo-3H-xanthen-9-yl)benzoic acid Investigative 3383 C20H12O5 332.3 C1=CC=C(C(=C1)C2=C3C=CC(=O)C=C3OC4=C2C=CC(=C4)O)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B1SMF4 Perindopril erbumine Investigative 441313 C23H43N3O5 441.6 CCC[C@@H](C(=O)OCC)N[C@@H](C)C(=O)N1[C@H]2CCCC[C@H]2C[C@H]1C(=O)O.CC(C)(C)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B1SY2R Oxytocin acetate Investigative 12004215 C45H70N12O14S2 1067.2 CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N1)CC2=CC=C(C=C2)O)N)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N.CC(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B21KSJ Guanfacine Investigative 3519 C9H9Cl2N3O 246.09 C1=CC(=C(C(=C1)Cl)CC(=O)N=C(N)N)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B28MJC (E)-But-2-enedioic acid;N-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide Investigative 9912089 C23H28N2O8 460.5 CC(CC1=CC=C(C=C1)OC)NCC(C2=CC(=C(C=C2)O)NC=O)O.C(=C/C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B29RUX Adiphenine Investigative 2031 C20H25NO2 311.4 CCN(CC)CCOC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2 IC50 = 158400 nM Poor binder T33969 ATP-binding cassette transporter B11 B2DP6E L-Hyoscyamine Investigative 3661; 6321299 C17H23NO3 289.4 CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B2SA1B Minovlar Investigative 9839243 C20H26O2 298.4 C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@]2(C#C)O)CCC4=CC(=O)CC[C@H]34 IC50 = 55000 nM Poor binder T33969 ATP-binding cassette transporter B11 B2ZW3Q Natamycin Investigative 5284447 C33H47NO13 665.7 C[C@@H]1C/C=C/C=C/C=C/C=C/[C@@H](C[C@H]2[C@@H]([C@H](C[C@](O2)(C[C@H](C[C@@H]3[C@H](O3)/C=C/C(=O)O1)O)O)O)C(=O)O)O[C@H]4[C@H]([C@H]([C@@H]([C@H](O4)C)O)N)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B32SAP Carbon tetrachloride Investigative 5943 CCl4 153.8 C(Cl)(Cl)(Cl)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B39XAJ Pemirolast potassium Investigative 443866 C10H7KN6O 266.3 CC1=CC=CN2C1=NC=C(C2=O)C3=NN=N[N-]3.[K+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B3KVX7 Bupivacaine hydrochloride Investigative 64737 C18H29ClN2O 324.9 CCCCN1CCCCC1C(=O)NC2=C(C=CC=C2C)C.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B3PX2N Idazoxan Investigative 54459 C11H12N2O2 204.22 C1CN=C(N1)C2COC3=CC=CC=C3O2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B47WJP Metocurine Investigative 21233 C40H48N2O6+2 652.8 C[N+]1(CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C6[C@@H](CC7=CC(=C(C=C7)OC)O3)[N+](CCC6=CC(=C5OC)OC)(C)C)OC)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B4CHM1 Terlipressin acetate Investigative 72734347 C54H78N16O17S2 1287.4 CC(=O)O.C1C[C@H](N(C1)C(=O)[C@@H]2CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2)CC(=O)N)CCC(=O)N)CC3=CC=CC=C3)CC4=CC=C(C=C4)O)NC(=O)CNC(=O)CNC(=O)CN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B4KT7N Aquex Investigative 2804 C14H20ClN3O3S 345.8 CC1CCCC(N1NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B4KYL0 N,N-Diethyl-4-[(3-fluoro-phenyl)-piperidin-4-ylidene-methyl]-benzamide Investigative 10570940 C23H27FN2O 366.5 CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCNCC2)C3=CC(=CC=C3)F IC50 = 86070 nM Poor binder T33969 ATP-binding cassette transporter B11 B4T0WK Enalapril maleate Investigative 5388961 C24H32N2O9 492.5 CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)O.C(=C\\C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B4UTY5 Ebastine Investigative 3191 C32H39NO2 469.7 CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)OC(C3=CC=CC=C3)C4=CC=CC=C4 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B4YJK1 Gemcitabine hydrochloride Investigative 60749 C9H12ClF2N3O4 299.66 C1=CN(C(=O)N=C1N)[C@H]2C([C@@H]([C@H](O2)CO)O)(F)F.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B51RBF Ergocalciferol Investigative 5280793 C28H44O 396.6 C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]\\2[C@@]1(CCC/C2=C\\C=C/3\\C[C@H](CCC3=C)O)C IC50 = 75800 nM Poor binder T33969 ATP-binding cassette transporter B11 B57LPK Ertapenem sodium Investigative 23674512 C22H24N3NaO7S 497.5 C[C@@H]1[C@@H]2[C@H](C(=O)N2C(=C1S[C@H]3C[C@H](NC3)C(=O)NC4=CC=CC(=C4)C(=O)[O-])C(=O)O)[C@@H](C)O.[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B5GN7B Somatostatin Investigative 16129706 C76H104N18O19S2 1637.9 C[C@H]([C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)CC5=CC=CC=C5)CC(=O)N)CCCCN)NC(=O)CNC(=O)[C@H](C)N)C(=O)O)CO)[C@@H](C)O)CC6=CC=CC=C6)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B5I4XW Ketorolac tromethamine Investigative 84003 C19H24N2O6 376.4 C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1C(=O)O.C(C(CO)(CO)N)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B5KY9W Cefotaxime sodium Investigative 10695961 C16H16N5NaO7S2 477.5 CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)/C(=N\\OC)/C3=CSC(=N3)N)SC1)C(=O)[O-].[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B5ORA4 Bromopride Investigative 2446 C14H22BrN3O2 344.25 CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC)N)Br IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B5PKM1 Procarbazine hydrochloride Investigative 9703 C12H20ClN3O 257.76 CC(C)NC(=O)C1=CC=C(C=C1)CNNC.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B5XS6Y Goserelin acetate Investigative 16052011 C61H88N18O16 1329.5 CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NNC(=O)N)NC(=O)[C@@H](COC(C)(C)C)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CC5=CN=CN5)NC(=O)[C@@H]6CCC(=O)N6.CC(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B65WUT Betamipron Investigative 71651 C10H11NO3 193.2 C1=CC=C(C=C1)C(=O)NCCC(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B6GXK2 (8S,9S,10R,13S,14S,16R,17S)-17-Acetyl-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-16-carbonitrile Investigative 21337710 C22H31NO2 341.5 CC(=O)[C@H]1[C@@H](C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CCC(C4)O)C)C)C#N IC50 ~ 135000 nM Poor binder T33969 ATP-binding cassette transporter B11 B6JZQ0 Chloroxylenol Investigative 2723 C8H9ClO 156.61 CC1=CC(=CC(=C1Cl)C)O IC50 = 129900 nM Poor binder T33969 ATP-binding cassette transporter B11 B6U8ZR Vincristine sulfate Investigative 249332 C46H58N4O14S 923 CC[C@@]1(C[C@@H]2C[C@@](C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C=O)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC)O.OS(=O)(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B6ULF0 Etoposide phosphate Investigative 6918092 C29H33O16P 668.5 C[C@@H]1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@@H](O2)O[C@H]3[C@H]4COC(=O)[C@@H]4[C@@H](C5=CC6=C(C=C35)OCO6)C7=CC(=C(C(=C7)OC)OP(=O)(O)O)OC)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B6UW7J Ceftin Investigative 6321416 C20H22N4O10S 510.5 CC(OC(=O)C)OC(=O)C1=C(CS[C@H]2N1C(=O)[C@H]2NC(=O)/C(=N\\OC)/C3=CC=CO3)COC(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B6Z5SC Eflornithine hydrochloride Investigative 57004 C6H13ClF2N2O2 218.63 C(CC(C(F)F)(C(=O)O)N)CN.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B71CUX Tobramycin Investigative 36294 C18H37N5O9 467.5 C1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)N)O)O)O[C@@H]3[C@@H](C[C@@H]([C@H](O3)CN)O)N)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B73JUE Solgol Investigative 4411 C17H27NO4 309.4 CC(C)(C)NCC(COC1=CC=CC2=C1CC(C(C2)O)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B7DYV4 Alendronate sodium Investigative 16760285 C4H12NNaO7P2 271.08 C(CC(O)(P(=O)(O)O)P(=O)(O)[O-])CN.[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B7LBN1 Dimethisoquin Investigative 6857 C17H24N2O 272.4 CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)C IC50 = 68680 nM Poor binder T33969 ATP-binding cassette transporter B11 B7O0WI Terbinafine hydrochloride Investigative 5282481 C21H26ClN 327.9 CC(C)(C)C#C/C=C/CN(C)CC1=CC=CC2=CC=CC=C21.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B7S0CH Bupropion hydrochloride Investigative 62884 C13H19Cl2NO 276.2 CC(C(=O)C1=CC(=CC=C1)Cl)NC(C)(C)C.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B7UV2C Pravastatin sodium Investigative 16759173 C23H35NaO7 446.5 CC[C@H](C)C(=O)O[C@H]1C[C@@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@H](C[C@H](CC(=O)[O-])O)O)O.[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B84VPC Dimenhydrinate Investigative 10660 C24H28ClN5O3 470 CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl.CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B85DNT Methyldopa hydrate Investigative 18530292 C10H15NO5 229.23 C[C@](CC1=CC(=C(C=C1)O)O)(C(=O)O)N.O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B8AMD2 2-[4-Chloro-2-(4-ethylsulfonyl-2-fluorophenyl)phenoxy]acetic acid Investigative 54585642 C16H14ClFO5S 372.8 CCS(=O)(=O)C1=CC(=C(C=C1)C2=C(C=CC(=C2)Cl)OCC(=O)O)F IC50 = 168300 nM Poor binder T33969 ATP-binding cassette transporter B11 B8E2PK N-[2-[(2S)-3-[[1-[(4-Chlorophenyl)methyl]piperidin-4-yl]amino]-2-hydroxy-2-methylpropoxy]phenyl]acetamide Investigative 10297363 C24H32ClN3O3 446 CC(=O)NC1=CC=CC=C1OC[C@](C)(CNC2CCN(CC2)CC3=CC=C(C=C3)Cl)O IC50 = 71540 nM Poor binder T33969 ATP-binding cassette transporter B11 B8H6WS 2-[(3S)-3-Aminopyrrolidin-1-yl]-6-chloro-N-(cyclohexylmethyl)quinoline-5-carboxamide Investigative 11176669 C21H27ClN4O 386.9 C1CCC(CC1)CNC(=O)C2=C(C=CC3=C2C=CC(=N3)N4CC[C@@H](C4)N)Cl IC50 = 106900 nM Poor binder T33969 ATP-binding cassette transporter B11 B8IA7H 6,7-Dimethoxy-3-(6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-2-benzofuran-1(3H)-one Investigative 1309 C21H21NO6 383.4 CN1CCC2=CC3=C(C=C2C1C4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OCO3 IC50 = 65640 nM Poor binder T33969 ATP-binding cassette transporter B11 B8SRI9 Imipenem hydrate Investigative 5282372 C12H19N3O5S 317.36 C[C@H]([C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)O)SCCN=CN)O.O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B8UC2V Sulfacetamide sodium Investigative 4022878 C8H9N2NaO3S 236.23 CC(=O)[N-]S(=O)(=O)C1=CC=C(C=C1)N.[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B91ONU 3,5-Dinitrobenzamide Investigative 4511 C7H5N3O5 211.13 C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)N IC50 = 184500 nM Poor binder T33969 ATP-binding cassette transporter B11 B93NQT (1R,2R,3R,6R,7S,9R,10R,12R,13S,15R,17S)-9-[(2S,3R,4S,6R)-4-(Dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3-ethyl-2,10-dihydroxy-7-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-15-(2-methoxyethoxymethyl)-2,6,10,12,17-pentamethyl-4,16-dioxa-14-azabicyclo[11.3.1]heptadecan-5-one Investigative 137654606 C41H76N2O14 821 CC[C@@H]1[C@@]([C@H]2[C@H]([C@H]([C@@H](C[C@@]([C@@H](C[C@@H]([C@H](C(=O)O1)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)O)(C)OC)O[C@H]4[C@@H]([C@H](C[C@H](O4)C)N(C)C)O)(C)O)C)N[C@H](O2)COCCOC)C)(C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B9L5CZ Ranitidine Base Investigative 5039 C13H22N4O3S 314.41 CNC(=C[N+](=O)[O-])NCCSCC1=CC=C(O1)CN(C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 B9P2MZ Pancuronium bromide Investigative 27350 C35H60Br2N2O4 732.7 CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1[N+]4(CCCCC4)C)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5OC(=O)C)[N+]6(CCCCC6)C)C.[Br-].[Br-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BA0OE1 Scopolamine hydrobromide trihydrate Investigative 20055509 C17H28BrNO7 438.3 CN1[C@@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4.O.O.O.Br IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BABV29 Triamcinolone acetonide Investigative 6436 C24H31FO6 434.5 C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)CO)CCC5=CC(=O)C=C[C@@]53C)F)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BAQ89X Doxepin Investigative 3158 C19H21NO 279.4 CN(C)CCC=C1C2=CC=CC=C2COC3=CC=CC=C31 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BAR85X Leuprolide acetate Investigative 657180 C61H88N16O14 1269.4 CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CC5=CN=CN5)NC(=O)[C@@H]6CCC(=O)N6.CC(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BB49LU Atracurium besylate Investigative 47320 C65H82N2O18S2 1243.5 C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)OC)OC)OC)CCC(=O)OCCCCCOC(=O)CC[N+]4(CCC5=CC(=C(C=C5C4CC6=CC(=C(C=C6)OC)OC)OC)OC)C.C1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BB6L0X Eptifibatide (acetate) Investigative 12001375 C37H53N11O11S2 892 CC(=O)O.C1C[C@H]2C(=O)N[C@@H](CSSCCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N2C1)CC3=CNC4=CC=CC=C43)CC(=O)O)CCCCN=C(N)N)C(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BB8AO6 2-[3-[(1-Ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Investigative 2311 C24H28N2O5 424.5 CCOC(=O)C(CCC1=CC=CC=C1)NC2CCC3=CC=CC=C3N(C2=O)CC(=O)O IC50 = 74860 nM Poor binder T33969 ATP-binding cassette transporter B11 BBT6Y9 Oxacillin sodium Investigative 23667631 C19H18N3NaO5S 423.4 CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)[O-].[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BBX29G Aminophylline Investigative 9433 C16H24N10O4 420.43 CN1C2=C(C(=O)N(C1=O)C)NC=N2.CN1C2=C(C(=O)N(C1=O)C)NC=N2.C(CN)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BC0DF5 N,N-Dimethyl-2-(6-methyl-2-(p-tolyl)imidazo[1,2-a]pyridin-3-yl)acetamide 2,3-dihydroxysuccinate Investigative 18004026 C23H27N3O7 457.5 CC1=CC=C(C=C1)C2=C(N3C=C(C=CC3=N2)C)CC(=O)N(C)C.C(C(C(=O)O)O)(C(=O)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BC3WO8 Aliskiren hemifumarate Investigative 6918427 C64H110N6O16 1219.6 CC(C)[C@@H](CC1=CC(=C(C=C1)OC)OCCCOC)C[C@@H]([C@H](C[C@@H](C(C)C)C(=O)NCC(C)(C)C(=O)N)O)N.CC(C)[C@@H](CC1=CC(=C(C=C1)OC)OCCCOC)C[C@@H]([C@H](C[C@@H](C(C)C)C(=O)NCC(C)(C)C(=O)N)O)N.C(=C/C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BCDS78 N-(1-Adamantylmethyl)-2-chloro-5-(piperazin-1-ylmethyl)benzamide Investigative 10046647 C23H32ClN3O 402 C1CN(CCN1)CC2=CC(=C(C=C2)Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4 IC50 = 124000 nM Poor binder T33969 ATP-binding cassette transporter B11 BCH53K Acepromazine Investigative 6077 C19H22N2OS 326.5 CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN(C)C IC50 = 111600 nM Poor binder T33969 ATP-binding cassette transporter B11 BD1WM4 Sulfanitran Investigative 5334 C14H13N3O5S 335.34 CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)[N+](=O)[O-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BD3IP0 Cibenzoline Investigative 2747 C18H18N2 262.3 C1CN=C(N1)C2CC2(C3=CC=CC=C3)C4=CC=CC=C4 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BD5AK1 Sodium;(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(2-methyl-5,6-dioxo-1H-1,2,4-triazin-3-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Investigative 16051965 C18H18N8NaO7S3+ 577.6 CN1C(=NC(=O)C(=O)N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)/C(=N\\OC)/C4=CSC(=N4)N)SC2)C(=O)O.[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BD5XJ0 (3E)-N-(4-Chlorophenyl)-3-isopropylimino-5-(p-tolyl)phenazin-2-amine Investigative 71595704 C28H25ClN4 453 CC1=CC=C(C=C1)N2C3=CC=CC=C3N=C4C2=CC(=NC(C)C)C(=C4)NC5=CC=C(C=C5)Cl IC50 = 134900 nM Poor binder T33969 ATP-binding cassette transporter B11 BD9XY0 Estrumate Investigative 23716436 C22H28ClNaO6 446.9 C1C(C(C(C1O)/C=C/C(COC2=CC(=CC=C2)Cl)O)C/C=C\\CCCC(=O)[O-])O.[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BDO6H9 Artesunate Investigative 6917864 C19H28O8 384.4 C[C@@H]1CC[C@H]2[C@H]([C@@H](O[C@H]3[C@@]24[C@H]1CC[C@](O3)(OO4)C)OC(=O)CCC(=O)O)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BDU1M3 Anthralin Investigative 2202 C14H10O3 226.23 C1C2=C(C(=CC=C2)O)C(=O)C3=C1C=CC=C3O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BDVT80 Strontium ranelate Investigative 6918182 C12H6N2O8SSr2 513.5 C(C1=C(SC(=C1C#N)N(CC(=O)[O-])CC(=O)[O-])C(=O)[O-])C(=O)[O-].[Sr+2].[Sr+2] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BDY51S Piperacillin sodium Investigative 23666879 C23H26N5NaO7S 539.5 CCN1CCN(C(=O)C1=O)C(=O)N[C@H](C2=CC=CC=C2)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)[O-].[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BESW08 1-Naphthyl isothiocyanate Investigative 11080 C11H7NS 185.25 C1=CC=C2C(=C1)C=CC=C2N=C=S IC50 = 60000 nM Poor binder T33969 ATP-binding cassette transporter B11 BEU30C Epirubicin hydrochloride Investigative 65348 C27H30ClNO11 580 C[C@H]1[C@@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BEY3H8 Kanamycin Investigative 6032 C18H36N4O11 484.5 C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)N)O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BF6A3D Bronopol Investigative 2450 C3H6BrNO4 199.99 C(C(CO)([N+](=O)[O-])Br)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BG25CF Ticlopidine hydrochloride Investigative 65335 C14H15Cl2NS 300.2 C1CN(CC2=C1SC=C2)CC3=CC=CC=C3Cl.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BG3PY9 Ketotifen fumarate Investigative 5282408 C23H23NO5S 425.5 CN1CCC(=C2C3=C(C(=O)CC4=CC=CC=C42)SC=C3)CC1.C(=C/C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BGC4L3 Baclofen Investigative 2284 C10H12ClNO2 213.66 C1=CC(=CC=C1C(CC(=O)O)CN)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BH06GC 2-(6-Methoxynaphthalen-2-yl)propan-1-ol Investigative 33341 C14H16O2 216.27 CC(CO)C1=CC2=C(C=C1)C=C(C=C2)OC IC50 = 97580 nM Poor binder T33969 ATP-binding cassette transporter B11 BH1WY8 Prolixin Investigative 6602611 C22H27ClF3N3OS 474 C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCO.Cl IC50 = 87300 nM Poor binder T33969 ATP-binding cassette transporter B11 BH2C6E Coltramyl Investigative 72067 C27H33NO10S 563.6 CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BHLU51 Ethambutol dihydrochloride Investigative 14051 C10H26Cl2N2O2 277.23 CC[C@@H](CO)NCCN[C@@H](CC)CO.Cl.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BHP1U8 Azlocillin sodium Investigative 23685176 C20H22N5NaO6S 483.5 CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)NC(=O)N4CCNC4=O)C(=O)[O-])C.[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BHW6D1 Dolasetron mesylate Investigative 3033817 C20H24N2O6S 420.5 CS(=O)(=O)O.C1[C@@H]2CC(C[C@H]3N2CC(=O)C1C3)OC(=O)C4=CNC5=CC=CC=C54 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BI1XC3 Propranolol Investigative 4946 C16H21NO2 259.339 CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BI32WT (-)-Tramadol Investigative 667511 C16H25NO2 263.37 CN(C)C[C@@H]1CCCC[C@]1(C2=CC(=CC=C2)OC)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BI83SP Flunisolide Investigative 82153 C24H31FO6 434.5 C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)CO)C[C@@H](C5=CC(=O)C=C[C@]35C)F)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BI8WN9 Duloxetine hydrochloride Investigative 60834 C18H20ClNOS 333.9 CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=CC=CC=C32.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BIQE35 Sildenafil citrate Investigative 135413523 C28H38N6O11S 666.7 CCCC1=NN(C2=C1N=C(NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O IC50 = 132000 nM Poor binder T33969 ATP-binding cassette transporter B11 BIRP38 Rizatriptan benzoate Investigative 77997 C22H25N5O2 391.5 CN(C)CCC1=CNC2=C1C=C(C=C2)CN3C=NC=N3.C1=CC=C(C=C1)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BJ2V4U Nefopam Investigative 4450 C17H19NO 253.34 CN1CCOC(C2=CC=CC=C2C1)C3=CC=CC=C3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BJ4HI8 Tilorone Investigative 5475 C25H34N2O3 410.5 CCN(CC)CCOC1=CC2=C(C=C1)C3=C(C2=O)C=C(C=C3)OCCN(CC)CC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BK4A1T Tolterodine tartrate Investigative 9847786 C26H37NO7 475.6 CC1=CC(=C(C=C1)O)[C@H](CCN(C(C)C)C(C)C)C2=CC=CC=C2.C(C(C(=O)O)O)(C(=O)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BK4DN9 Fluticasone propionate Investigative 444036 C25H31F3O5S 500.6 CCC(=O)O[C@@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2C[C@@H](C4=CC(=O)C=C[C@@]43C)F)F)O)C)C)C(=O)SCF IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BKC4E6 Oseltamivir phosphate Investigative 78000 C16H31N2O8P 410.4 CCC(CC)O[C@@H]1C=C(C[C@@H]([C@H]1NC(=O)C)N)C(=O)OCC.OP(=O)(O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BKG38V Rocuronium bromide Investigative 441351 C32H53BrN2O4 609.7 CC(=O)O[C@H]1[C@H](C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(C[C@@H]([C@H](C4)O)N5CCOCC5)C)C)[N+]6(CCCC6)CC=C.[Br-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BKH3A8 Minocycline hydrochloride Investigative 54685925 C23H28ClN3O7 493.9 CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(C=CC(=C4C(=C3C(=O)[C@@]2(C(=C(C1=O)C(=O)N)O)O)O)O)N(C)C.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BKUX96 Ziprasidone mesylate Investigative 154068 C22H25ClN4O4S2 509 CS(=O)(=O)O.C1CN(CCN1CCC2=C(C=C3C(=C2)CC(=O)N3)Cl)C4=NSC5=CC=CC=C54 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BL4H9B Quinidine Investigative 441074 C20H24N2O2 324.4 COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3C[C@@H]4CCN3C[C@@H]4C=C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BL84ZA Vecuronium bromide Investigative 39764 C34H57BrN2O4 637.7 CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1N4CCCCC4)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5OC(=O)C)[N+]6(CCCCC6)C)C.[Br-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BLH83D Artemether Investigative 68911 C16H26O5 298.37 C[C@@H]1CC[C@H]2[C@H]([C@H](O[C@H]3[C@@]24[C@H]1CC[C@](O3)(OO4)C)OC)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BLPK42 N-(1-Adamantylmethyl)-2-chloro-5-[(2R)-2-hydroxy-3-(methylamino)propyl]benzamide Investigative 21107392 C22H31ClN2O2 390.9 CNC[C@@H](CC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3)O IC50 = 133200 nM Poor binder T33969 ATP-binding cassette transporter B11 BM4H6J Artemisinin Investigative 68827 C15H22O5 282.33 C[C@@H]1CC[C@H]2[C@H](C(=O)O[C@H]3[C@@]24[C@H]1CC[C@](O3)(OO4)C)C IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BMEO84 Trazodone hydrochloride Investigative 62935 C19H23Cl2N5O 408.3 C1CN(CCN1CCCN2C(=O)N3C=CC=CC3=N2)C4=CC(=CC=C4)Cl.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BMI9A4 Cefazolin sodium Investigative 23675322 C14H13N8NaO4S3 476.5 CC1=NN=C(S1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)CN4C=NN=N4)SC2)C(=O)[O-].[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BMLW83 Atomoxetine hydrochloride Investigative 54840 C17H22ClNO 291.8 CC1=CC=CC=C1O[C@H](CCNC)C2=CC=CC=C2.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BN18SJ Pazufloxacin Investigative 65957 C16H15FN2O4 318.3 C[C@H]1COC2=C3N1C=C(C(=O)C3=CC(=C2C4(CC4)N)F)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BN40ZF Talniflumate Investigative 48229 C21H13F3N2O4 414.3 C1=CC=C2C(=C1)C(OC2=O)OC(=O)C3=C(N=CC=C3)NC4=CC=CC(=C4)C(F)(F)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BN6AT4 Lansoprazole Investigative 3883 C16H14F3N3O2S 369.4 CC1=C(C=CN=C1CS(=O)C2=NC3=CC=CC=C3N2)OCC(F)(F)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BNX8Y3 8-[4-Methyl-3-[(5Z)-5-[(Z)-[5-[[2-methyl-5-[(4,6,8-trisulfo-2H-naphthalen-1-ylidene)carbamoyl]cyclohexa-2,4-dien-1-ylidene]carbamoyl]cyclohexa-2,4-dien-1-ylidene]carbamoyl]iminocyclohexa-1,3-diene-1-carbonyl]iminocyclohexa-1,4-diene-1-carbonyl]imino-7H-naphthalene-1,3,5-trisulfonic acid Investigative 73355036 C51H40N6O23S6 1297.3 CC1=CCC(=CC1=NC(=O)C2=CC=C/C(=N\\C(=O)/N=C\\3/CC(=CC=C3)C(=O)N=C4CC(=CC=C4C)C(=O)N=C5CC=C(C6=C5C(=CC(=C6)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)/C2)C(=O)N=C7CC=C(C8=C7C(=CC(=C8)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O IC50 = 107000 nM Poor binder T33969 ATP-binding cassette transporter B11 BO3AY9 Triamcinolone diacetate Investigative 6216 C25H31FO8 478.5 CC(=O)OCC(=O)[C@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)OC(=O)C)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BO42CG Diethyldithiocarbamic acid Investigative 8987 C5H11NS2 149.3 CCN(CC)C(=S)S IC50 = 69260 nM Poor binder T33969 ATP-binding cassette transporter B11 BP0NC8 Vincaleukoblastine Investigative 241903 C46H58N4O9 811 CC[C@@]1(C[C@@H]2C[C@@](C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BP92SB 4H-1-Benzopyran-2-carboxylic acid, 6,8-diethyl-5-hydroxy-4-oxo- Investigative 161944 C14H14O5 262.26 CCC1=CC(=C2C(=C1O)C(=O)C=C(O2)C(=O)O)CC IC50 = 111700 nM Poor binder T33969 ATP-binding cassette transporter B11 BPZH19 Loxapine succinate Investigative 71399 C22H24ClN3O5 445.9 CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)Cl.C(CC(=O)O)C(=O)O IC50 = 77000 nM Poor binder T33969 ATP-binding cassette transporter B11 BQ0I9V Nebivolol hydrochloride Investigative 9933004 C22H26ClF2NO4 441.9 C1CC2=C(C=CC(=C2)F)OC1C(CNCC(C3CCC4=C(O3)C=CC(=C4)F)O)O.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BQ74DH Stepronin Investigative 54120 C10H11NO4S2 273.3 CC(C(=O)NCC(=O)O)SC(=O)C1=CC=CS1 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BQ7P9C Tegaserod maleate Investigative 135413539 C20H27N5O5 417.5 CCCCCN=C(N)N/N=C/C1=CNC2=C1C=C(C=C2)OC.C(=C\\C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BQC4B2 Mafenide acetate Investigative 25590 C9H14N2O4S 246.29 CC(=O)O.C1=CC(=CC=C1CN)S(=O)(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BQT3O4 Varenicline tartrate Investigative 46783232 C17H19N3O6 361.3 C1C2CNCC1C3=CC4=NC=CN=C4C=C23.C(C(C(=O)O)O)(C(=O)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BQWB80 Iohexol Investigative 3730 C19H26I3N3O9 821.1 CC(=O)N(CC(CO)O)C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)C(=O)NCC(CO)O)I IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BR46CV Cefpodoxime proxetil Investigative 6526396 C21H27N5O9S2 557.6 CC(C)OC(=O)OC(C)OC(=O)C1=C(CS[C@H]2N1C(=O)[C@H]2NC(=O)/C(=N\\OC)/C3=CSC(=N3)N)COC IC50 = 81700 nM Poor binder T33969 ATP-binding cassette transporter B11 BRXU85 Filipin III from Streptomyces filipinensis, >=85% (HPLC) Investigative 5351611 C35H58O11 654.8 CCCCCC(C1C(CC(CC(CC(CC(CC(CC(/C(=C\\C=C\\C=C\\C=C\\C=C\\C(C(OC1=O)C)O)/C)O)O)O)O)O)O)O)O IC50 = 164000 nM Poor binder T33969 ATP-binding cassette transporter B11 BS8IQ0 Butyl 4-aminobenzoate Investigative 2482 C11H15NO2 193.24 CCCCOC(=O)C1=CC=C(C=C1)N IC50 = 181100 nM Poor binder T33969 ATP-binding cassette transporter B11 BSC98O Toremifene citrate Investigative 3005572 C32H36ClNO8 598.1 CN(C)CCOC1=CC=C(C=C1)/C(=C(/CCCl)\\C2=CC=CC=C2)/C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O IC50 = 115000 nM Poor binder T33969 ATP-binding cassette transporter B11 BSO5R4 Rosuvastatin calcium Investigative 5282455 C44H54CaF2N6O12S2 1001.1 CC(C1=NC(=NC(=C1/C=C/[C@@H](O)C[C@@H](O)CC(=O)[O-])C2=CC=C(C=C2)F)N(S(=O)(=O)C)C)C.CC(C1=NC(=NC(=C1/C=C/[C@@H](O)C[C@@H](O)CC(=O)[O-])C2=CC=C(C=C2)F)N(S(=O)(=O)C)C)C.[Ca+2] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BT2RC8 Gemifloxacin mesylate Investigative 9588170 C19H24FN5O7S 485.5 CO/N=C/1\\CN(CC1CN)C2=C(C=C3C(=O)C(=CN(C3=N2)C4CC4)C(=O)O)F.CS(=O)(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BT3CA9 Desmopressin acetate Investigative 9833407 C48H68N14O14S2 1129.3 CC(=O)O.C1C[C@H](N(C1)C(=O)[C@@H]2CSSCCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2)CC(=O)N)CCC(=O)N)CC3=CC=CC=C3)CC4=CC=C(C=C4)O)C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(=O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BT4XH8 Nikethamide Investigative 5497 C10H14N2O 178.23 CCN(CC)C(=O)C1=CN=CC=C1 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BT61JL Flumethasone Investigative 16490 C22H28F2O5 410.5 C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)F)C)F IC50 = 68460 nM Poor binder T33969 ATP-binding cassette transporter B11 BTK47E Escitalopram oxalate Investigative 146571 C22H23FN2O5 414.4 CN(C)CCC[C@@]1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F.C(=O)(C(=O)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BTM19J Gestodene Investigative 3033968 C21H26O2 310.4 CC[C@]12CC[C@H]3[C@H]([C@@H]1C=C[C@]2(C#C)O)CCC4=CC(=O)CC[C@H]34 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BU2YQ6 Hydroxychloroquine sulfate Investigative 12947 C18H28ClN3O5S 434 CCN(CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)CCO.OS(=O)(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BU34NM Clomifene Investigative 2800 C26H28ClNO 406 CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=CC=C3 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BUC4D6 Chembl4299247 Investigative 145948937 C23H46N6O13 614.6 C1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)N)O[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O[C@@H]4[C@@H]([C@H]([C@@H](C(O4)CN)O)O)N)O)O)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BVC18Y Warfarin sodium Investigative 16204922 C19H15NaO4 330.3 CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)[O-].[Na+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BVL86Y Salmeterol xinafoate Investigative 56801 C36H45NO7 603.7 C1=CC=C(C=C1)CCCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O.C1=CC=C2C(=C1)C=CC(=C2O)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BVO6K9 trans-2-Phenylcyclopropylamine Investigative 26070 C9H11N 133.19 C1[C@@H]([C@H]1N)C2=CC=CC=C2 IC50 = 102700 nM Poor binder T33969 ATP-binding cassette transporter B11 BVRB31 N,N-Diethyl-4-(phenyl(piperidin-4-ylidene)methyl)benzamide Investigative 9841259 C23H28N2O 348.5 CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCNCC2)C3=CC=CC=C3 IC50 = 105800 nM Poor binder T33969 ATP-binding cassette transporter B11 BW8Z6M Chlorpheniramine Investigative 2725 C16H19ClN2 274.79 CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BWM89J N-(3,4-Dichlorobenzyl)-5-acetoxyindole-2-carboxylic acid Investigative 22718737 C18H13Cl2NO4 378.2 CC(=O)OC1=CC2=C(C=C1)N(C(=C2)C(=O)O)CC3=CC(=C(C=C3)Cl)Cl IC50 = 55210 nM Poor binder T33969 ATP-binding cassette transporter B11 BWOS92 Dexbrompheniramine maleate Investigative 6433334 C20H23BrN2O4 435.3 CN(C)CC[C@@H](C1=CC=C(C=C1)Br)C2=CC=CC=N2.C(=C\\C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BX5LQ7 N-[2-[(2S)-3-[[1-[(4-Chlorophenyl)methyl]piperidin-4-yl]amino]-2-hydroxypropoxy]phenyl]acetamide Investigative 10119887 C23H30ClN3O3 432 CC(=O)NC1=CC=CC=C1OC[C@H](CNC2CCN(CC2)CC3=CC=C(C=C3)Cl)O IC50 = 55570 nM Poor binder T33969 ATP-binding cassette transporter B11 BXNT61 2-Thenoyltrifluoroacetone Investigative 5601 C8H5F3O2S 222.19 C1=CSC(=C1)C(=O)CC(=O)C(F)(F)F IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BXSK48 Fesoterodine fumarate Investigative 9849808 C30H41NO7 527.6 CC(C)C(=O)OC1=C(C=C(C=C1)CO)[C@H](CCN(C(C)C)C(C)C)C2=CC=CC=C2.C(=C/C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BXU7F5 Moxifloxacin hydrochloride Investigative 101526 C21H25ClFN3O4 437.9 COC1=C2C(=CC(=C1N3C[C@@H]4CCCN[C@@H]4C3)F)C(=O)C(=CN2C5CC5)C(=O)O.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BXZ30V Feprazone Investigative 35455 C20H20N2O2 320.4 CC(=CCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)C IC50 = 73900 nM Poor binder T33969 ATP-binding cassette transporter B11 BY92XQ Ornidazole Investigative 28061 C7H10ClN3O3 219.62 CC1=NC=C(N1CC(CCl)O)[N+](=O)[O-] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BY9I8W Saxagliptin hydrochloride Investigative 49800073 C18H26ClN3O2 351.9 C1[C@@H]2C[C@@H]2N([C@@H]1C#N)C(=O)[C@H](C34CC5CC(C3)CC(C5)(C4)O)N.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BYG98Z Dronedarone hydrochloride Investigative 219025 C31H45ClN2O5S 593.2 CCCCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C)C(=O)C3=CC=C(C=C3)OCCCN(CCCC)CCCC.Cl IC50 = 73900 nM Poor binder T33969 ATP-binding cassette transporter B11 BZ2AL0 Benztropine Investigative 1201549 C21H25NO 307.4 CN1[C@@H]2CC[C@H]1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4 IC50 = 188600 nM Poor binder T33969 ATP-binding cassette transporter B11 BZ7ME3 Doxycycline hydrochloride Investigative 54685920 C22H25ClN2O8 480.9 C[C@@H]1[C@H]2[C@@H]([C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BZ8AT5 Pranoprofen Investigative 4888 C15H13NO3 255.27 CC(C1=CC2=C(C=C1)OC3=C(C2)C=CC=N3)C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BZ9E1A Brompheniramine maleate Investigative 5281067 C20H23BrN2O4 435.3 CN(C)CCC(C1=CC=C(C=C1)Br)C2=CC=CC=N2.C(=C\\C(=O)O)\\C(=O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 BZD25O Fenoldopam mesylate Investigative 49659 C17H20ClNO6S 401.9 CS(=O)(=O)O.C1CNCC(C2=CC(=C(C(=C21)Cl)O)O)C3=CC=C(C=C3)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D00REB AZ11657312 (salt free) Investigative 11193842 C26H35N3O3 437.6 CC1=C(C=C(C=C1)C(=O)N2CC3CNCC(C2)O3)NC(=O)CC45CC6CC(C4)CC(C6)C5 IC50 = 59510 nM Poor binder T33969 ATP-binding cassette transporter B11 D01BJB pregnenolone-16alpha-carbonitrile Investigative 15032 C22H31NO2 341.5 CC(=O)[C@H]1[C@@H](C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C#N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D01OIK xamoterol Investigative 155774 C16H25N3O5 339.39 C1COCCN1C(=O)NCCNCC(COC2=CC=C(C=C2)O)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D02CWP taurolithocholic acid-3-sulphate Investigative 439763 C26H45NO5S 483.7 C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C IC50 = 189200 nM Poor binder T33969 ATP-binding cassette transporter B11 D02YSX DIMEBOLIN Investigative 197033 C21H25N3 319.4 CC1=CC2=C(C=C1)N(C3=C2CN(CC3)C)CCC4=CN=C(C=C4)C IC50 = 135900 nM Poor binder T33969 ATP-binding cassette transporter B11 D03IRR Phenazone Investigative 2206 C11H12N2O 188.23 CC1=CC(=O)N(N1C)C2=CC=CC=C2 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D03IVG imiloxan Investigative 133621 C14H16N2O2 244.29 CCN1C=CN=C1CC2COC3=CC=CC=C3O2 IC50 = 61650 nM Poor binder T33969 ATP-binding cassette transporter B11 D04ALU [3H](+)-cis-diltiazem Investigative 3076 C22H26N2O4S 414.5 CC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC IC50 = 82020 nM Poor binder T33969 ATP-binding cassette transporter B11 D04LBT Antimycin A Investigative 14957 C28H40N2O9 548.6 CCCCCC[C@@H]1[C@H]([C@@H](OC(=O)[C@H]([C@H](OC1=O)C)NC(=O)C2=C(C(=CC=C2)NC=O)O)C)OC(=O)CC(C)C IC50 = 59600 nM Poor binder T33969 ATP-binding cassette transporter B11 D05BCF Clavulanate+Amoxicillin Investigative 23665591 C8H8KNO5 237.25 C1[C@@H]2N(C1=O)[C@H](/C(=C/CO)/O2)C(=O)[O-].[K+] IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D07GXY piribedil Investigative 4850 C16H18N4O2 298.34 C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=NC=CC=N4 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D08CNS IPRONIAZIDE Investigative 3748 C9H13N3O 179.22 CC(C)NNC(=O)C1=CC=NC=C1 IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D09XCX PIRINIXIC ACID Investigative 5694 C14H14ClN3O2S 323.8 CC1=C(C(=CC=C1)NC2=CC(=NC(=N2)SCC(=O)O)Cl)C IC50 = 75000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0D8RC Metformin Investigative 4091 C4H11N5 129.16 CN(C)C(=N)N=C(N)N IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0J6JT m-chlorophenylpiperazine Investigative 1355 C10H13ClN2 196.67 C1CN(CCN1)C2=CC(=CC=C2)Cl IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0K2KR Eplerenone Investigative 443872 C24H30O6 414.5 C[C@]12CCC(=O)C=C1C[C@H]([C@@H]3[C@]24[C@H](O4)C[C@]5([C@H]3CC[C@@]56CCC(=O)O6)C)C(=O)OC IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0O2DQ Mepacrine Investigative 237 C23H30ClN3O 400 CCN(CC)CCCC(C)NC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC IC50 = 101100 nM Poor binder T33969 ATP-binding cassette transporter B11 D0RN5A [3H]naloxone Investigative 5284596 C19H21NO4 327.4 C=CCN1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)O)O4)O IC50 = 133000 nM Poor binder T33969 ATP-binding cassette transporter B11 D0UK7Z Emetine hydrochloride Investigative 10219 C29H40N2O4 480.6 CC[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@@H]1C[C@@H]4C5=CC(=C(C=C5CCN4)OC)OC)OC)OC IC50 = 133000 nM Poor binder