TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T31992 Carbonic anhydrase XIV B4OX3Q (E)-4-(4-Hydroxyphenyl)-1-[(2S,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]but-3-en-2-one Investigative 71521576 C16H20O7 324.32 C1=CC(=CC=C1/C=C/C(=O)C[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)O Ki ~ 100000 nM Poor binder T31992 Carbonic anhydrase XIV B4SPD9 2,4-Dihydroxybenzoic acid Investigative 1491 C7H6O4 154.12 C1=CC(=C(C=C1O)O)C(=O)O Ki = 70000 nM Poor binder T31992 Carbonic anhydrase XIV B8TDZ9 Spermine(hbbh) Investigative 389642 C20H42N4O4 402.6 CC(C)(C)OC(=O)N(CCCCN(CCCN)C(=O)OC(C)(C)C)CCCN Ki = 115000 nM Poor binder T31992 Carbonic anhydrase XIV BBIJ27 (E)-4-(3-Hydroxyphenyl)-1-[(2S,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]but-3-en-2-one Investigative 71521497 C16H20O7 324.32 C1=CC(=CC(=C1)O)/C=C/C(=O)C[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O Ki ~ 100000 nM Poor binder T31992 Carbonic anhydrase XIV BG65MT 2,5-Dihydroxybenzoic acid Investigative 3469 C7H6O4 154.12 C1=CC(=C(C=C1O)C(=O)O)O Ki = 67000 nM Poor binder T31992 Carbonic anhydrase XIV BS58HU N1,N3-Bis(2-(2,2,2-trifluoroacetamido)ethyl)-propane-1,3-diaminium trifluoroacetate Investigative 46899573 C11H18F6N4O2 352.28 C(CNCCNC(=O)C(F)(F)F)CNCCNC(=O)C(F)(F)F Ki = 125000 nM Poor binder T31992 Carbonic anhydrase XIV BV0I2K N1,N12-Bis(trifluoroacetyl)-N4,N8-bis(t-butoxycarbonyl)spermine Investigative 389641 C24H40F6N4O6 594.6 CC(C)(C)OC(=O)N(CCCCN(CCCNC(=O)C(F)(F)F)C(=O)OC(C)(C)C)CCCNC(=O)C(F)(F)F Ki = 85000 nM Poor binder T31992 Carbonic anhydrase XIV BV29IP Tert-butyl N-(dipropylsulfamoyl)carbamate Investigative 44424366 C11H24N2O4S 280.39 CCCN(CCC)S(=O)(=O)NC(=O)OC(C)(C)C Ki = 52600 nM Poor binder T31992 Carbonic anhydrase XIV D0EJ9B Phenyl Boronic acid Investigative 66827 C6H7BO2 121.93 B(C1=CC=CC=C1)(O)O Ki ~ 50000 nM Poor binder T31992 Carbonic anhydrase XIV D0M6RM Phenylarsonic acid Investigative 7365 C6H7AsO3 202.04 C1=CC=C(C=C1)[As](=O)(O)O Ki = 84000 nM Poor binder