TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T13852 Sphingosine-1-phosphate receptor 1 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 T13852 Sphingosine-1-phosphate receptor 1 B1BW0S 4-Chloro-N-[1-(2,3-dimethylimidazol-4-yl)-2-phenylethyl]benzenesulfonamide Investigative 118729161 C19H20ClN3O2S 389.9 CC1=NC=C(N1C)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl EC50 ~ 100000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 B27HCT N-Cyclohexyl-5-cyclopropylisoxazole-3-carboxamide Investigative 16188020 C13H18N2O2 234.29 C1CCC(CC1)NC(=O)C2=NOC(=C2)C3CC3 EC50 ~ 50000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 B3PI0A N,N-Dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide Investigative 56955982 C21H32N2O2 344.5 C1CCC(CC1)N(C2CCCCC2)C(=O)C3=NOC(=C3)C4CCCC4 EC50 ~ 50000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 B4P9QV N-Cyclohexyl-5-cyclopropyl-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide Investigative 25110500 C18H26N2O3 318.4 C1CCC(CC1)N(C2CCOCC2)C(=O)C3=NOC(=C3)C4CC4 EC50 ~ 50000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 B4W5RX 4-[2-[4-[(2-Chlorophenyl)methoxy]phenyl]ethyl]-2-oxo-1,3-oxazolidine-4-carboxamide Investigative 57403950 C19H19ClN2O4 374.8 C1C(NC(=O)O1)(CCC2=CC=C(C=C2)OCC3=CC=CC=C3Cl)C(=O)N EC50 ~ 100000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 B5HMI7 5-[(4-Naphthalen-2-yl-1-benzothiophen-2-yl)methylamino]pentanoic acid Investigative 134130884 C24H23NO2S 389.5 C1=CC=C2C=C(C=CC2=C1)C3=C4C=C(SC4=CC=C3)CNCCCCC(=O)O EC50 ~ 100000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 B5R8PM N-Cyclopentyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide Investigative 25110510 C19H28N2O2 316.4 CC1CCCCC1N(C2CCCC2)C(=O)C3=NOC(=C3)C4CC4 EC50 ~ 50000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 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 T13852 Sphingosine-1-phosphate receptor 1 B9P8DB 2-[(4-Naphthalen-2-yl-1-benzothiophen-2-yl)methylamino]acetic acid Investigative 134130695 C21H17NO2S 347.4 C1=CC=C2C=C(C=CC2=C1)C3=C4C=C(SC4=CC=C3)CNCC(=O)O EC50 ~ 100000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 BC81HS N-Cyclohexyl-N-cyclopentyl-5-cyclopropyl-1,2-oxazole-3-carboxamide Investigative 25110492 C18H26N2O2 302.4 C1CCC(CC1)N(C2CCCC2)C(=O)C3=NOC(=C3)C4CC4 EC50 ~ 50000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 BDP9E8 N-Cyclohexyl-N-(cyclohexylmethyl)-5-cyclopropyl-1,2-oxazole-3-carboxamide Investigative 25110494 C20H30N2O2 330.5 C1CCC(CC1)CN(C2CCCCC2)C(=O)C3=NOC(=C3)C4CC4 EC50 ~ 50000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 BE8PY2 4-[(4-Naphthalen-2-yl-1-benzothiophen-2-yl)methylamino]butanoic acid Investigative 134131381 C23H21NO2S 375.5 C1=CC=C2C=C(C=CC2=C1)C3=C4C=C(SC4=CC=C3)CNCCCC(=O)O EC50 ~ 100000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 BG9M4T N,N-Dicyclohexyl-5-methylisoxazole-3-carboxamide Investigative 3245758 C17H26N2O2 290.4 CC1=CC(=NO1)C(=O)N(C2CCCCC2)C3CCCCC3 EC50 ~ 50000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 BIWV59 N-[1-(4-Benzyl-5-methyl-1,2,4-triazol-3-yl)-2-phenylethyl]-4-chlorobenzenesulfonamide Investigative 118729156 C24H23ClN4O2S 467 CC1=NN=C(N1CC2=CC=CC=C2)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)Cl EC50 ~ 100000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 BP64OR N-Benzyl-5-cyclopropyl-N-pyridin-2-yl-1,2-oxazole-3-carboxamide Investigative 25110212 C19H17N3O2 319.4 C1CC1C2=CC(=NO2)C(=O)N(CC3=CC=CC=C3)C4=CC=CC=N4 EC50 ~ 50000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 BQ43ZB 3-[(4-Naphthalen-2-yl-1-benzothiophen-2-yl)methylamino]propanoic acid Investigative 134130546 C22H19NO2S 361.5 C1=CC=C2C=C(C=CC2=C1)C3=C4C=C(SC4=CC=C3)CNCCC(=O)O EC50 ~ 100000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 BR5K2G US9187437, 42 (comparative) Investigative 89707709 C20H20N2O 304.4 C1CCC(C(C1)C2=CC=CC=C2)C3=NC(=NO3)C4=CC=CC=C4 EC50 ~ 62000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 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 T13852 Sphingosine-1-phosphate receptor 1 BV69NL N,N,5-Tricyclohexyl-1,2-oxazole-3-carboxamide Investigative 56955980 C22H34N2O2 358.5 C1CCC(CC1)C2=CC(=NO2)C(=O)N(C3CCCCC3)C4CCCCC4 EC50 ~ 50000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 BVWK65 N-Cyclohexyl-5-propyl-3-isoxazolecarboxamide Investigative 5307570 C13H20N2O2 236.31 CCCC1=CC(=NO1)C(=O)NC2CCCCC2 EC50 ~ 50000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 BWHI48 N-Cyclohexyl-N-phenyl-5-propyl-1,2-oxazole-3-carboxamide Investigative 25110105 C19H24N2O2 312.4 CCCC1=CC(=NO1)C(=O)N(C2CCCCC2)C3=CC=CC=C3 EC50 ~ 50000 nM Poor binder T13852 Sphingosine-1-phosphate receptor 1 BZ6EI1 4-({[7-(Naphthalen-2-yl)-1-benzothiophen-2-yl]methyl}amino)butanoic acid Investigative 124221654 C23H21NO2S 375.5 C1=CC=C2C=C(C=CC2=C1)C3=CC=CC4=C3SC(=C4)CNCCCC(=O)O EC50 ~ 100000 nM Poor binder