TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T89041 Steroid 17-alpha-monooxygenase D09LNI Fluconazole Approved 3365 C13H12F2N6O 306.27 C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O IC50 > 200000 nM Non binder T89041 Steroid 17-alpha-monooxygenase B19SJI 3-Capabh Investigative 125921 C18H22N2O2 298.4 C1CCC(CC1)CN2C(=O)C3CC3(C2=O)C4=CC=C(C=C4)N IC50 > 330000 nM Non binder T89041 Steroid 17-alpha-monooxygenase BZO1X4 N-[(8R,9S,10R,13S,14S)-17-(Benzimidazol-1-yl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-ylidene]hydroxylamine Investigative 87178837 C26H31N3O 401.5 C[C@]12CCC(=NO)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC=C4N5C=NC6=CC=CC=C65)C IC50 = 258000 nM Non binder