TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T17523 Sphingosine-1-phosphate receptor 4 B0QTB3 5-Cyclopropyl-N,N-bis(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide Investigative 25110496 C21H32N2O2 344.5 CC1CCCCC1N(C2CCCCC2C)C(=O)C3=NOC(=C3)C4CC4 EC50 ~ 50000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 B0S6HN 1-[(7-Naphthalen-2-yl-1-benzothiophen-2-yl)methyl]azetidine-3-carboxylic acid Investigative 134131291 C23H19NO2S 373.5 C1C(CN1CC2=CC3=C(S2)C(=CC=C3)C4=CC5=CC=CC=C5C=C4)C(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 B2NTB9 N-Cyclohexyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide Investigative 25110498 C20H30N2O2 330.5 CC1CCCCC1N(C2CCCCC2)C(=O)C3=NOC(=C3)C4CC4 EC50 ~ 50000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 B37OZG 3-[[7-(2-Ethylphenyl)-1-benzothiophen-2-yl]methylamino]-2-methylpropanoic acid Investigative 134130146 C21H23NO2S 353.5 CCC1=CC=CC=C1C2=CC=CC3=C2SC(=C3)CNCC(C)C(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 B4J6YM 3-[[4-(2-Ethylphenyl)-1-benzothiophen-2-yl]methylamino]propanoic acid Investigative 134131038 C20H21NO2S 339.5 CCC1=CC=CC=C1C2=C3C=C(SC3=CC=C2)CNCCC(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 B4M2FA 4-[[[4-(2-Ethylphenyl)-1-benzothiophen-2-yl]methylamino]methyl]benzoic acid Investigative 134131043 C25H23NO2S 401.5 CCC1=CC=CC=C1C2=C3C=C(SC3=CC=C2)CNCC4=CC=C(C=C4)C(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 B71WOI 4-[[[7-(2-Ethylphenyl)-1-benzothiophen-2-yl]methylamino]methyl]benzoic acid Investigative 134131495 C25H23NO2S 401.5 CCC1=CC=CC=C1C2=CC=CC3=C2SC(=C3)CNCC4=CC=C(C=C4)C(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 B8C2JN 1-[(5-Naphthalen-2-yl-1-benzothiophen-2-yl)methyl]azetidine-3-carboxylic acid Investigative 134130169 C23H19NO2S 373.5 C1C(CN1CC2=CC3=C(S2)C=CC(=C3)C4=CC5=CC=CC=C5C=C4)C(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 B9FK5Y N,N-Dicyclohexyl-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide Investigative 25110484 C23H30N2O3 382.5 COC1=CC=C(C=C1)C2=CC(=NO2)C(=O)N(C3CCCCC3)C4CCCCC4 EC50 ~ 50000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BAY37Q 2-[[7-(2-Ethylphenyl)-1-benzothiophen-2-yl]methylamino]acetic acid Investigative 134130960 C19H19NO2S 325.4 CCC1=CC=CC=C1C2=CC=CC3=C2SC(=C3)CNCC(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BC19LT 2-[4-[(5-Naphthalen-2-yl-1-benzothiophen-2-yl)methylamino]phenyl]acetic acid Investigative 134130704 C27H21NO2S 423.5 C1=CC=C2C=C(C=CC2=C1)C3=CC4=C(C=C3)SC(=C4)CNC5=CC=C(C=C5)CC(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BEZ3M1 4-[[(5-Naphthalen-2-yl-1-benzothiophen-2-yl)methylamino]methyl]benzoic acid Investigative 134130243 C27H21NO2S 423.5 C1=CC=C2C=C(C=CC2=C1)C3=CC4=C(C=C3)SC(=C4)CNCC5=CC=C(C=C5)C(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BG0W7S N-Cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide Investigative 25110499 C21H32N2O2 344.5 CC1CCCCC1N(C2CCCCCC2)C(=O)C3=NOC(=C3)C4CC4 EC50 ~ 50000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BGXS76 3-[[7-(2-Ethylphenyl)-1-benzothiophen-2-yl]methylamino]propanoic acid Investigative 134130022 C20H21NO2S 339.5 CCC1=CC=CC=C1C2=CC=CC3=C2SC(=C3)CNCCC(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BJ6C3D 2-[3-[(5-Naphthalen-2-yl-1-benzothiophen-2-yl)methylamino]phenyl]acetic acid Investigative 134131316 C27H21NO2S 423.5 C1=CC=C2C=C(C=CC2=C1)C3=CC4=C(C=C3)SC(=C4)CNC5=CC=CC(=C5)CC(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BJL58W 2-Amino-3-[[4-(2-ethylphenyl)-1-benzothiophen-2-yl]methylamino]propanoic acid Investigative 134130071 C20H22N2O2S 354.5 CCC1=CC=CC=C1C2=C3C=C(SC3=CC=C2)CNCC(C(=O)O)N EC50 = 57600 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BK1GQ4 N,N-Dicyclohexyl[5-(methylethyl)isoxazol-3-yl]carboxamide Investigative 17253281 C19H30N2O2 318.5 CC(C)C1=CC(=NO1)C(=O)N(C2CCCCC2)C3CCCCC3 EC50 ~ 50000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BLOK46 1-[[4-(2-Ethylphenyl)-1-benzothiophen-2-yl]methyl]azetidine-3-carboxylic acid Investigative 134130538 C21H21NO2S 351.5 CCC1=CC=CC=C1C2=C3C=C(SC3=CC=C2)CN4CC(C4)C(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BNC0D7 N,N-Dicyclohexyl-5-cyclopropyl-3-isoxazolecarboxamide Investigative 17253208 C19H28N2O2 316.4 C1CCC(CC1)N(C2CCCCC2)C(=O)C3=NOC(=C3)C4CC4 EC50 ~ 50000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BPH2S4 2-(7-(5-(3-Cyano-5-(trifluoromethoxy)phenyl)-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-yl)acetic Acid Investigative 44138103 C23H15F3N4O4 468.4 C1CN2C3=C(C=C(C=C3)C4=NOC(=N4)C5=CC(=CC(=C5)C#N)OC(F)(F)F)C=C2C1CC(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BR74WC N,N-Dicyclohexyl-5-phenyl-1,2-oxazole-3-carboxamide Investigative 25110488 C22H28N2O2 352.5 C1CCC(CC1)N(C2CCCCC2)C(=O)C3=NOC(=C3)C4=CC=CC=C4 EC50 ~ 50000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BR7MV0 2-[[4-(2-Ethylphenyl)-1-benzothiophen-2-yl]methylamino]acetic acid Investigative 134130203 C19H19NO2S 325.4 CCC1=CC=CC=C1C2=C3C=C(SC3=CC=C2)CNCC(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BS45MD S1P1 Agonist III Investigative 54764919 C21H16F3N3O3 415.4 COC1=C(C=NC=C1)C(=O)NC(=O)NC2=CC(=C(C=C2)C3=CC=CC=C3)C(F)(F)F EC50 ~ 50000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BT5W9N 5-[[7-(2-Ethylphenyl)-1-benzothiophen-2-yl]methylamino]pentanoic acid Investigative 134130188 C22H25NO2S 367.5 CCC1=CC=CC=C1C2=CC=CC3=C2SC(=C3)CNCCCCC(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BTP8G2 4-[[(4-Naphthalen-2-yl-1-benzothiophen-2-yl)methylamino]methyl]benzoic acid Investigative 134130548 C27H21NO2S 423.5 C1=CC=C2C=C(C=CC2=C1)C3=C4C=C(SC4=CC=C3)CNCC5=CC=C(C=C5)C(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BVGI57 4-[[(7-Naphthalen-2-yl-1-benzothiophen-2-yl)methylamino]methyl]benzoic acid Investigative 134130183 C27H21NO2S 423.5 C1=CC=C2C=C(C=CC2=C1)C3=CC=CC4=C3SC(=C4)CNCC5=CC=C(C=C5)C(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BW05GV 2-[4-[(4-Naphthalen-2-yl-1-benzothiophen-2-yl)methylamino]phenyl]acetic acid Investigative 134131130 C27H21NO2S 423.5 C1=CC=C2C=C(C=CC2=C1)C3=C4C=C(SC4=CC=C3)CNC5=CC=C(C=C5)CC(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BWM42X N,N-Dicyclohexyl-5-propyl-3-isoxazolecarboxamide Investigative 5309153 C19H30N2O2 318.5 CCCC1=CC(=NO1)C(=O)N(C2CCCCC2)C3CCCCC3 EC50 ~ 50000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BX6I8B 1-[[7-(2-Ethylphenyl)-1-benzothiophen-2-yl]methyl]azetidine-3-carboxylic acid Investigative 134131039 C21H21NO2S 351.5 CCC1=CC=CC=C1C2=CC=CC3=C2SC(=C3)CN4CC(C4)C(=O)O EC50 ~ 100000 nM Poor binder T17523 Sphingosine-1-phosphate receptor 4 BZ0FP5 4-[[7-(2-Ethylphenyl)-1-benzothiophen-2-yl]methylamino]butanoic acid Investigative 134130622 C21H23NO2S 353.5 CCC1=CC=CC=C1C2=CC=CC3=C2SC(=C3)CNCCCC(=O)O EC50 ~ 100000 nM Poor binder