TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T19244 S-mephenytoin 4-hydroxylase D08QCJ Thiabendazole Approved 5430 C10H7N3S 201.25 C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3 Ki = 245000 nM Non binder T19244 S-mephenytoin 4-hydroxylase D06ZVC WAY-181187 Discontinued in Phase 1 10150497 C15H13ClN4O2S2 380.9 C1=CC=C2C(=C1)C(=CN2S(=O)(=O)C3=C(N=C4N3C=CS4)Cl)CCN IC50 > 500000 nM Non binder T19244 S-mephenytoin 4-hydroxylase B09BPL 1-[5-(6-Methoxynaphthalen-2-yl)pyridin-3-yl]ethanone Investigative 25034348 C18H15NO2 277.3 CC(=O)C1=CN=CC(=C1)C2=CC3=C(C=C2)C=C(C=C3)OC IC50 > 200000 nM Non binder T19244 S-mephenytoin 4-hydroxylase B0YA2H Pyridine, 3-(4-methyl-1H-imidazol-1-yl)- Investigative 44388612 C9H9N3 159.19 CC1=CN(C=N1)C2=CN=CC=C2 IC50 > 300000 nM Non binder T19244 S-mephenytoin 4-hydroxylase B29YTW 2-(4-Fluoro-benzenesulfonylamino)-N-(1-formyl-3-methyl-butyl)-3-methyl-butyramide Investigative 10861643 C17H25FN2O4S 372.5 CC(C)C[C@H](C=O)NC(=O)[C@H](C(C)C)NS(=O)(=O)C1=CC=C(C=C1)F IC50 = 492000 nM Non binder T19244 S-mephenytoin 4-hydroxylase B2QHP6 Pyridine, 2-fluoro-5-(4-methyl-3-thienyl)- Investigative 11389927 C10H8FNS 193.24 CC1=CSC=C1C2=CN=C(C=C2)F IC50 > 400000 nM Non binder T19244 S-mephenytoin 4-hydroxylase B4QX3P Dimethyl[3-(pyridin-3-yl)prop-2-yn-1-yl]amine Investigative 10654534 C10H12N2 160.22 CN(C)CC#CC1=CN=CC=C1 Ki > 400000 nM Non binder T19244 S-mephenytoin 4-hydroxylase B4ZE8L 2-(4-{[(2S)-8-Methyl-2,3-dihydro[1,4]dioxino[2,3-f]quinolin-2-yl]methyl}piperazin-1-yl)-quinoline-6-carbonitrile Investigative 44192200 C27H25N5O2 451.5 CC1=NC2=C(C=C1)C3=C(C=C2)OC[C@@H](O3)CN4CCN(CC4)C5=NC6=C(C=C5)C=C(C=C6)C#N IC50 = 358000 nM Non binder T19244 S-mephenytoin 4-hydroxylase B5X4MU 4-Allyl-N-benzyl-N-(2-phenyl-2H-pyrazol-3-yl)-benzenesulfonamide Investigative 10895263 C25H23N3O2S 429.5 C=CCC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=NN3C4=CC=CC=C4 IC50 > 200000 nM Non binder T19244 S-mephenytoin 4-hydroxylase B68KGF 4-Allyl-N-methyl-N-(2-phenyl-2H-pyrazol-3-yl)-benzenesulfonamide Investigative 10948187 C19H19N3O2S 353.4 CN(C1=CC=NN1C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)CC=C IC50 > 200000 nM Non binder T19244 S-mephenytoin 4-hydroxylase B7WX4U 3,3'-Bipyridine Investigative 68487 C10H8N2 156.18 C1=CC(=CN=C1)C2=CN=CC=C2 IC50 > 300000 nM Non binder T19244 S-mephenytoin 4-hydroxylase B8YKP1 (5-Pyridin-3-ylthiophen-2-yl)methanamine;(5-pyridin-3-ylthiophen-2-yl)methanimine Investigative 44388657 C30H26N6S3 566.8 C1=CC(=CN=C1)C2=CC=C(S2)CN.C1=CC(=CN=C1)C2=CC=C(S2)C=N.C1=CC(=CN=C1)C2=CC=C(S2)C=N IC50 = 208000 nM Non binder T19244 S-mephenytoin 4-hydroxylase BB3H5J 2-[[2-(3,4-Dichlorophenoxy)phenyl]methylsulfinyl]acetamide Investigative 11588489 C15H13Cl2NO3S 358.2 C1=CC=C(C(=C1)CS(=O)CC(=O)N)OC2=CC(=C(C=C2)Cl)Cl IC50 = 216000 nM Non binder T19244 S-mephenytoin 4-hydroxylase BK36VF (NZ)-N-[(5-pyridin-3-ylfuran-2-yl)methylidene]hydroxylamine Investigative 11355925 C10H8N2O2 188.18 C1=CC(=CN=C1)C2=CC=C(O2)/C=N\\O IC50 = 398000 nM Non binder T19244 S-mephenytoin 4-hydroxylase BPKY46 3-(2-Methyl-1H-imidazol-1-yl)pyridine Investigative 16654686 C9H9N3 159.19 CC1=NC=CN1C2=CN=CC=C2 Ki > 300000 nM Non binder T19244 S-mephenytoin 4-hydroxylase BV1B3U 5-Hydroxy saxagliptin Investigative 23645678 C18H25N3O3 331.4 C1[C@@H]2C[C@@H]2N([C@@H]1C#N)C(=O)[C@H](C34CC5CC(C3)(CC(C5)(C4)O)O)N IC50 > 200000 nM Non binder T19244 S-mephenytoin 4-hydroxylase BV8YP7 3-(Pyridin-3-yl)propan-1-amine Investigative 13557523 C8H12N2 136.19 C1=CC(=CN=C1)CCCN Ki > 400000 nM Non binder T19244 S-mephenytoin 4-hydroxylase BXWL30 (5R)-3-[3-Fluoro-4-(1-oxidotetrahydro-2H-thiopyran-4-yl)phenyl]-2-oxo-1,3-oxazolidine-5-carboxamide Investigative 23729988 C15H17FN2O4S 340.4 C1CS(=O)CCC1C2=C(C=C(C=C2)N3C[C@@H](OC3=O)C(=O)N)F IC50 > 900000 nM Non binder T19244 S-mephenytoin 4-hydroxylase BY4K6H 3-Methyl-4-phenylthiophene Investigative 11993868 C11H10S 174.26 CC1=CSC=C1C2=CC=CC=C2 Ki > 400000 nM Non binder T19244 S-mephenytoin 4-hydroxylase BY96PQ Pyridine, 2-fluoro-5-(3-thienyl)- Investigative 11389737 C9H6FNS 179.22 C1=CC(=NC=C1C2=CSC=C2)F IC50 > 400000 nM Non binder T19244 S-mephenytoin 4-hydroxylase D06HOI BMS-269223 Investigative 44249821 C23H28N6O3 436.5 CC1=CC2=C(O1)C=CC(=C2)NC(=N[C@H]3CCCCN(C3=O)CC(=O)N4CCCC4)NC#N IC50 > 200000 nM Non binder T19244 S-mephenytoin 4-hydroxylase D0J1QT BMS-344577 Investigative 44473100 C31H37N7O5 587.7 CC1=CC2=C(O1)C=CC(=C2)NC(=N[C@H]3CCCCN(C3=O)CC(=O)N4CCCC4)NC(=O)C5=CN=C(C=C5)C(=O)N(C)C IC50 > 200000 nM Non binder T19244 S-mephenytoin 4-hydroxylase D0VD5O 2-fluoro-5-(3-methylthiophen-2-yl)pyridine Investigative 11148236 C10H8FNS 193.24 CC1=C(SC=C1)C2=CN=C(C=C2)F Ki > 400000 nM Non binder