TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T21357 Phosphodiesterase 3B 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 ~ 50000 nM Poor binder T21357 Phosphodiesterase 3B B0A9ID N-(4-Methoxybenzyl)-3-(cyclopentyloxy)-4-(difluoromethoxy)benzamide Investigative 122193679 C21H23F2NO4 391.4 COC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)OC(F)F)OC3CCCC3 IC50 ~ 100000 nM Poor binder T21357 Phosphodiesterase 3B B0KNS3 (2R,8R)-2-(2,4-Dichlorophenyl)-6-ethyl-3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraene-4,7-dione Investigative 50925469 C22H19Cl2N3O2 428.3 CCN1CC(=O)N2[C@@H](C1=O)CC3=C([C@H]2C4=C(C=C(C=C4)Cl)Cl)NC5=CC=CC=C35 IC50 ~ 50000 nM Poor binder T21357 Phosphodiesterase 3B B2DJ1U N-(2-Chlorophenyl)-3-cyclopentyloxy-4-(difluoromethoxy)benzamide Investigative 134129996 C19H18ClF2NO3 381.8 C1CCC(C1)OC2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3Cl)OC(F)F IC50 ~ 100000 nM Poor binder T21357 Phosphodiesterase 3B B3VWM4 4-[2-[2-(2-Fluoroethoxy)ethoxy]ethoxy]-2-[[4-(1-methyl-4-pyridin-4-ylpyrazol-3-yl)phenoxy]methyl]quinoline Investigative 122193709 C31H31FN4O4 542.6 CN1C=C(C(=N1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C(=C3)OCCOCCOCCF)C5=CC=NC=C5 IC50 = 61900 nM Poor binder T21357 Phosphodiesterase 3B B48LUC Chembl4206423 Investigative 145978345 C23H28N2O5S 444.5 CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC(=C(C=C3C2)OC4CCCC4)OC IC50 ~ 100000 nM Poor binder T21357 Phosphodiesterase 3B B4PA8F 3-Methoxy-2-[[4-[4-(4-pyridyl)-1-methyl-1H-pyrazole-3-yl]phenoxy]methyl]quinoline Investigative 90665374 C26H22N4O2 422.5 CN1C=C(C(=N1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3OC)C5=CC=NC=C5 IC50 = 82700 nM Poor binder T21357 Phosphodiesterase 3B B5GSN2 Chembl4215772 Investigative 145974174 C25H26F3NO6 493.5 COC1=C(C=C2CN(C(CC2=C1)C(=O)OC)C(=O)C3=CC=C(C=C3)OC(F)(F)F)OC4CCCC4 IC50 ~ 100000 nM Poor binder T21357 Phosphodiesterase 3B B8VUQ4 3-(Cyclopropylmethoxy)-4-(difluoromethoxy)-N-pyridin-3-ylbenzamide Investigative 134130563 C17H16F2N2O3 334.32 C1CC1COC2=C(C=CC(=C2)C(=O)NC3=CN=CC=C3)OC(F)F IC50 ~ 100000 nM Poor binder T21357 Phosphodiesterase 3B B9FXI0 4-[2-[2-(2-Fluoroethoxy)ethoxy]ethoxy]-2-[[4-(2-methyl-4-pyridin-4-ylpyrazol-3-yl)phenoxy]methyl]quinoline Investigative 122193931 C31H31FN4O4 542.6 CN1C(=C(C=N1)C2=CC=NC=C2)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C(=C4)OCCOCCOCCF IC50 = 51800 nM Poor binder T21357 Phosphodiesterase 3B BQI63Y 6-Fluoro-2-[[4-(2-methyl-4-pyridin-4-ylpyrazol-3-yl)phenoxy]methyl]quinoline Investigative 122193935 C25H19FN4O 410.4 CN1C(=C(C=N1)C2=CC=NC=C2)C3=CC=C(C=C3)OCC4=NC5=C(C=C4)C=C(C=C5)F IC50 = 151000 nM Poor binder T21357 Phosphodiesterase 3B BQIK50 4-Fluoro-2-[[4-(1-methyl-4-pyridin-4-ylpyrazol-3-yl)phenoxy]methyl]quinoline Investigative 122193703 C25H19FN4O 410.4 CN1C=C(C(=N1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C(=C3)F)C5=CC=NC=C5 IC50 = 103000 nM Poor binder T21357 Phosphodiesterase 3B BS8V1A (10R,15S)-10-(2,4-Dichlorophenyl)-13-ethyl-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6-tetraene-12,14-dione Investigative 50925470 C21H17Cl2N3O2 414.3 CCN1C(=O)[C@@H]2CC3=C([C@H](N2C1=O)C4=C(C=C(C=C4)Cl)Cl)NC5=CC=CC=C35 IC50 ~ 50000 nM Poor binder T21357 Phosphodiesterase 3B BXLO05 3-Cyclopentyloxy-4-(difluoromethoxy)-N-pyridin-3-ylbenzamide Investigative 134130328 C18H18F2N2O3 348.3 C1CCC(C1)OC2=C(C=CC(=C2)C(=O)NC3=CN=CC=C3)OC(F)F IC50 ~ 100000 nM Poor binder T21357 Phosphodiesterase 3B BYVU78 N-(2-Chlorophenyl)-3(cyclopropylmethoxy)-4-(difluoromethoxy)benzamide Investigative 134131162 C18H16ClF2NO3 367.8 C1CC1COC2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3Cl)OC(F)F IC50 ~ 100000 nM Poor binder T21357 Phosphodiesterase 3B BZ5MY4 4-[2-(2-Fluoroethoxy)ethoxy]-2-[[4-(2-methyl-4-pyridin-4-ylpyrazol-3-yl)phenoxy]methyl]quinoline Investigative 122193930 C29H27FN4O3 498.5 CN1C(=C(C=N1)C2=CC=NC=C2)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C(=C4)OCCOCCF IC50 = 50100 nM Poor binder