TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T54156 Matrix metalloproteinase-9 D00HNB Clodronate Approved 25419 CH4Cl2O6P2 244.89 C(P(=O)(O)O)(P(=O)(O)O)(Cl)Cl IC50 = 320000 nM Non binder T54156 Matrix metalloproteinase-9 B0XE9S ((4S,5S)-2-Heptyl-5-vinyl-4,5-dihydro-oxazol-4-yl)-methanol Investigative 44394727 C13H23NO2 225.33 CCCCCCCC1=N[C@H]([C@@H](O1)C=C)CO Ki > 2000000 nM Non binder T54156 Matrix metalloproteinase-9 B37BEO (S)-N-Hydroxy-2,5-bis(4-iodophenylsulfonamido)pentanamide Investigative 44576877 C17H19I2N3O6S2 679.3 C1=CC(=CC=C1S(=O)(=O)NCCC[C@@H](C(=O)NO)NS(=O)(=O)C2=CC=C(C=C2)I)I Ki = 221000 nM Non binder T54156 Matrix metalloproteinase-9 B4I0GO ((4S,5S)-2-Pentyl-5-vinyl-4,5-dihydro-oxazol-4-yl)-methanol Investigative 44394721 C11H19NO2 197.27 CCCCCC1=N[C@H]([C@@H](O1)C=C)CO Ki > 2000000 nM Non binder T54156 Matrix metalloproteinase-9 B4P2DM (2R)-1-[(2-Chlorophenyl)methyl]-N-hydroxy-5-oxopyrrolidine-2-carboxamide Investigative 57393177 C12H13ClN2O3 268.69 C1CC(=O)N([C@H]1C(=O)NO)CC2=CC=CC=C2Cl IC50 > 500000 nM Non binder T54156 Matrix metalloproteinase-9 B4QEH7 (2R)-2-[(3R)-3-Amino-3-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]-2-oxopyrrolidin-1-yl]-N-hydroxy-3-methylbutanamide Investigative 53320639 C26H30N4O4 462.5 CC1=NC2=CC=CC=C2C(=C1)COC3=CC=C(C=C3)[C@@]4(CCN(C4=O)[C@H](C(C)C)C(=O)NO)N IC50 = 460000 nM Non binder T54156 Matrix metalloproteinase-9 B5AXL3 (2R)-1-[(4-Chlorophenyl)methyl]-N-hydroxy-5-oxopyrrolidine-2-carboxamide Investigative 57393178 C12H13ClN2O3 268.69 C1CC(=O)N([C@H]1C(=O)NO)CC2=CC=C(C=C2)Cl IC50 = 430000 nM Non binder T54156 Matrix metalloproteinase-9 B68HAL 2-(Benzyl-hydroxycarbamoylmethyl-amino)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide Investigative 25178356 C19H24N4O5S 420.5 C1=CC=C(C=C1)CN(CC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)CC(=O)NO IC50 > 300000 nM Non binder T54156 Matrix metalloproteinase-9 B6WV8B (S)-N-Hydroxy-2,5-bis(4-(trifluoromethyl)phenylsulfonamido)pentanamide Investigative 44576851 C19H19F6N3O6S2 563.5 C1=CC(=CC=C1C(F)(F)F)S(=O)(=O)NCCC[C@@H](C(=O)NO)NS(=O)(=O)C2=CC=C(C=C2)C(F)(F)F Ki = 329000 nM Non binder T54156 Matrix metalloproteinase-9 B7FWD5 L-Leucyl-L-phenylalanine methylamide Investigative 18394511 C16H25N3O2 291.39 CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC)N IC50 > 300000 nM Non binder T54156 Matrix metalloproteinase-9 B8R9AG D-Leucyl-L-phenylalanine methylamide Investigative 15296844 C16H25N3O2 291.39 CC(C)C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC)N IC50 > 300000 nM Non binder T54156 Matrix metalloproteinase-9 BB98UI 3,2-Diguanidinoneamine Investigative 23645953 C14H30N8O6 406.44 C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N=C(N)N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)N=C(N)N)O)O)N Ki > 300000 nM Non binder T54156 Matrix metalloproteinase-9 BBJ17R (S)-2-Benzenesulfonylamino-N-hydroxy-3-phenyl-propionamide Investigative 44372668 C15H16N2O4S 320.4 C1=CC=C(C=C1)C[C@@H](C(=O)NO)NS(=O)(=O)C2=CC=CC=C2 IC50 > 1000000 nM Non binder T54156 Matrix metalloproteinase-9 BGV24B Neamine guanidinylated deriv. 29 Investigative 23645959 C20H42N12O6 546.6 CO[C@H]1[C@@H](C[C@@H]([C@H]([C@@H]1OC)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN=C(N)N)OC)OC)N=C(N)N)N=C(N)N)N=C(N)N Ki > 300000 nM Non binder T54156 Matrix metalloproteinase-9 BIFP05 2-Amino-5-(4-((thiiran-2-ylmethyl)sulfonyl)phenoxy)phenol Investigative 54757202 C15H15NO4S2 337.4 C1C(S1)CS(=O)(=O)C2=CC=C(C=C2)OC3=CC(=C(C=C3)N)O Ki = 490000 nM Non binder T54156 Matrix metalloproteinase-9 BK2ZL3 Neamine guanidinylated deriv. 4 Investigative 9957228 C16H34N12O6 490.5 C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N=C(N)N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN=C(N)N)O)O)N=C(N)N)O)O)N=C(N)N Ki > 300000 nM Non binder T54156 Matrix metalloproteinase-9 BMDV75 ((4S,5S)-2-Phenyl-5-vinyl-4,5-dihydro-oxazol-4-yl)-methanol Investigative 44394814 C12H13NO2 203.24 C=C[C@H]1[C@@H](N=C(O1)C2=CC=CC=C2)CO Ki > 4000000 nM Non binder T54156 Matrix metalloproteinase-9 BMY37I Chembl4202548 Investigative 145976989 C22H20O4S2 412.5 COC1=CC=C(C=C1)C2=CC=C(C=C2)SC3=CC=CC=C3C(=O)CS(=O)(=O)C IC50 = 332000 nM Non binder T54156 Matrix metalloproteinase-9 BR7N6M N-Hydroxy-2,3-bis(perfluorophenylsulfonamido)propanamide Investigative 44576806 C15H7F10N3O6S2 579.4 C(C(C(=O)NO)NS(=O)(=O)C1=C(C(=C(C(=C1F)F)F)F)F)NS(=O)(=O)C2=C(C(=C(C(=C2F)F)F)F)F Ki = 212000 nM Non binder T54156 Matrix metalloproteinase-9 BSK63Q Z-L-Leu-L-Phe-OMe Investigative 13968141 C24H30N2O5 426.5 CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC)NC(=O)OCC2=CC=CC=C2 IC50 > 300000 nM Non binder T54156 Matrix metalloproteinase-9 BW5FE4 1,3,2-Triguanidinoneamine Investigative 11328354 C15H32N10O6 448.48 C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N=C(N)N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)N=C(N)N)O)O)N=C(N)N Ki > 300000 nM Non binder T54156 Matrix metalloproteinase-9 BY38MR (4S,5S)-2-(4-Chloro-phenyl)-4-phenylsulfanyl-5-vinyl-4,5-dihydro-oxazole Investigative 44394702 C17H14ClNOS 315.8 C=C[C@H]1[C@@H](N=C(O1)C2=CC=C(C=C2)Cl)SC3=CC=CC=C3 Ki > 200000 nM Non binder T54156 Matrix metalloproteinase-9 D00TRF 2-(benzyloxyamino)-N-hydroxyacetamide Investigative 44423683 C9H12N2O3 196.2 C1=CC=C(C=C1)CONCC(=O)NO IC50 = 256000 nM Non binder T54156 Matrix metalloproteinase-9 D05BMD 2-(4-chlorobenzyloxyamino)-N-hydroxyacetamide Investigative 44423684 C9H11ClN2O3 230.65 C1=CC(=CC=C1CONCC(=O)NO)Cl IC50 = 261000 nM Non binder T54156 Matrix metalloproteinase-9 D07VXX 2-(benzyloxyamino)-N-hydroxy-3-methylpentanamide Investigative 16721024 C13H20N2O3 252.31 CCC(C)C(C(=O)NO)NOCC1=CC=CC=C1 IC50 = 352000 nM Non binder