TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T40103 Cathepsin H D0J2VB Iboctadekin + rituximab Phase 1 5478883 C34H63N5O9 685.9 C[C@@H](C(=O)N[C@@H](CC(C)C)[C@H](CC(=O)O)O)NC(=O)C[C@@H]([C@H](CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)CC(C)C)O IC50 ~ 100000 nM Poor binder T40103 Cathepsin H D0U2SS MDL-2170 Terminated 11199915 C22H26N2O4 382.5 CC(C)[C@@H](C(=O)NC(CC1=CC=CC=C1)C=O)NC(=O)OCC2=CC=CC=C2 IC50 ~ 100000 nM Poor binder T40103 Cathepsin H B16GAX Chembl4228921 Investigative 145988823 C23H21N5O5 447.4 C1CN(CCC1CNC(=O)C2=CC(=C3C=CC=NC3=C2O)[N+](=O)[O-])C4=NC5=CC=CC=C5O4 Ki = 108000 nM Poor binder T40103 Cathepsin H B20ZUP 5-((2,3-Dimethylphenoxy)methyl)-3-methyloxazolidin-2-one Investigative 44426056 C13H17NO3 235.28 CC1=C(C(=CC=C1)OCC2CN(C(=O)O2)C)C IC50 ~ 100000 nM Poor binder T40103 Cathepsin H B29TFB 2-Methyl-5-nitroquinoline-8-ol Investigative 12737307 C10H8N2O3 204.18 CC1=NC2=C(C=CC(=C2C=C1)[N+](=O)[O-])O Ki = 89000 nM Poor binder T40103 Cathepsin H B2VAN9 (3R,4R)-4-(2,3-Dimethylphenoxy)piperidin-3-ol Investigative 13186896 C13H19NO2 221.29 CC1=C(C(=CC=C1)O[C@@H]2CCNC[C@H]2O)C IC50 ~ 100000 nM Poor binder T40103 Cathepsin H B5B7YV Trifluoroethylamine inhibitor, 2 Investigative 23648277 C16H17BrF3N3O3S 468.3 CS(=O)(=O)C[C@@H](C(=O)NC1(CC1)C#N)N[C@@H](C2=CC=C(C=C2)Br)C(F)(F)F IC50 ~ 50000 nM Poor binder T40103 Cathepsin H B5DBM8 3-Acetyl-5,8-dibromo-2-(4-bromophenylamino)quinolin-4(1H)-one Investigative 44565900 C17H11Br3N2O2 515 CC(=O)C1=C(NC2=C(C=CC(=C2C1=O)Br)Br)NC3=CC=C(C=C3)Br IC50 = 91760 nM Poor binder T40103 Cathepsin H B5I6RB (2R)-2-Amino-N-[(1S,2S)-1-cyano-2-phenylcyclopropyl]-3-thiophen-2-ylpropanamide;2,2,2-trifluoroacetic acid Investigative 49797572 C19H18F3N3O3S 425.4 C1[C@H]([C@@]1(C#N)NC(=O)[C@@H](CC2=CC=CS2)N)C3=CC=CC=C3.C(=O)(C(F)(F)F)O IC50 ~ 50000 nM Poor binder T40103 Cathepsin H B7BSG8 7-(Cyanomethylaminomethyl)-5-nitro-8-quinolinol Investigative 71520324 C12H10N4O3 258.23 C1=CC2=C(C=C(C(=C2N=C1)O)CNCC#N)[N+](=O)[O-] Ki = 129000 nM Poor binder T40103 Cathepsin H B9RI7L (2S)-2-Amino-N-[(1R,2R)-1-cyano-2-phenylcyclopropyl]-3-thiophen-2-ylpropanamide;2,2,2-trifluoroacetic acid Investigative 49797573 C19H18F3N3O3S 425.4 C1[C@@H]([C@]1(C#N)NC(=O)[C@H](CC2=CC=CS2)N)C3=CC=CC=C3.C(=O)(C(F)(F)F)O IC50 ~ 50000 nM Poor binder T40103 Cathepsin H BAVB51 (1S,2S)-2-Bromo-7-oxa-5-aza-bicyclo[3.2.1]octan-6-one Investigative 24901102 C6H8BrNO2 206.04 C1CN2C[C@@H]([C@H]1Br)OC2=O IC50 ~ 100000 nM Poor binder T40103 Cathepsin H BC1QT7 Z-FF-Fmk Investigative 11705307 C27H27FN2O4 462.5 C1=CC=C(C=C1)C[C@@H](C(=O)CF)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3 IC50 ~ 100000 nM Poor binder T40103 Cathepsin H BD8UG7 3-Acetyl-6-chloro-2-(2-chloro-4-methylphenylamino)-8-nitroquinolin-4(1H)-one Investigative 44566195 C18H13Cl2N3O4 406.2 CC1=CC(=C(C=C1)NC2=C(C(=O)C3=C(N2)C(=CC(=C3)Cl)[N+](=O)[O-])C(=O)C)Cl IC50 ~ 100000 nM Poor binder T40103 Cathepsin H BDEJ85 3-(1-Benzyloxycarbonyl-3-methyl-butylcarbamoyl)-1-(2-tert-butoxycarbonylamino-3-phenyl-propionyl)-aziridine-2-carboxylic acid ethyl ester Investigative 10746284 C33H43N3O8 609.7 CCOC(=O)[C@H]1[C@@H](N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)OCC3=CC=CC=C3 Ki = 137000 nM Poor binder T40103 Cathepsin H BEK87S 3-Acetyl-8-bromo-5-chloro-2-(4-chlorophenylamino)quinolin-4(1H)-one Investigative 44565901 C17H11BrCl2N2O2 426.1 CC(=O)C1=C(NC2=C(C=CC(=C2C1=O)Cl)Br)NC3=CC=C(C=C3)Cl IC50 ~ 100000 nM Poor binder T40103 Cathepsin H BF9C4I (3S,4R)-4-(2,3-Dimethylphenoxy)piperidin-3-ol Investigative 6917747 C13H19NO2 221.29 CC1=C(C(=CC=C1)O[C@@H]2CCNC[C@@H]2O)C IC50 ~ 100000 nM Poor binder T40103 Cathepsin H BKVT70 3-Acetyl-5,8-dichloro-2-(2,4-dichlorophenylamino)quinolin-4(1H)-one Investigative 44219712 C17H10Cl4N2O2 416.1 CC(=O)C1=C(NC2=C(C=CC(=C2C1=O)Cl)Cl)NC3=C(C=C(C=C3)Cl)Cl IC50 ~ 100000 nM Poor binder T40103 Cathepsin H BM61WY 1-(2-Benzyloxycarbonylamino-propionyl)-aziridine-2,3-dicarboxylic acid diethyl ester Investigative 10668225 C19H24N2O7 392.4 CCOC(=O)[C@@H]1[C@H](N1C(=O)[C@H](C)NC(=O)OCC2=CC=CC=C2)C(=O)OCC Ki = 160000 nM Poor binder T40103 Cathepsin H BNHQ54 cis-(S)-2-Amino-N-((1R,2R)-1-cyano-2-phenylcyclopropyl)-3-(thiophen-2-yl)propanamide Investigative 24822701 C17H17N3OS 311.4 C1[C@@H]([C@]1(C#N)NC(=O)[C@H](CC2=CC=CS2)N)C3=CC=CC=C3 IC50 ~ 50000 nM Poor binder T40103 Cathepsin H BSN5D6 3-Acetyl-8-chloro-2-(2,4-dibromophenylamino)-5-methylquinolin-4(1H)-one Investigative 44565925 C18H13Br2ClN2O2 484.6 CC1=C2C(=C(C=C1)Cl)NC(=C(C2=O)C(=O)C)NC3=C(C=C(C=C3)Br)Br IC50 = 66520 nM Poor binder T40103 Cathepsin H BU43OX (1R,2S)-2-Phenoxy-7-oxa-5-aza-bicyclo[3.2.1]octane-6-thione Investigative 44426055 C12H13NO2S 235.3 C1CN2C[C@H]([C@H]1OC3=CC=CC=C3)OC2=S IC50 ~ 100000 nM Poor binder T40103 Cathepsin H BVKR62 3-Acetyl-2-(4-tert-butylphenylamino)-8-chloro-6-nitroquinolin-4(1H)-one Investigative 44566188 C21H20ClN3O4 413.9 CC(=O)C1=C(NC2=C(C1=O)C=C(C=C2Cl)[N+](=O)[O-])NC3=CC=C(C=C3)C(C)(C)C IC50 ~ 100000 nM Poor binder T40103 Cathepsin H BW5U1T 2-Amino-N-[(1R,2R)-1-cyano-2-phenylcyclopropyl]-3-(3-fluorothiophen-2-yl)propanamide;2,2,2-trifluoroacetic acid Investigative 49797571 C19H17F4N3O3S 443.4 C1[C@@H]([C@]1(C#N)NC(=O)C(CC2=C(C=CS2)F)N)C3=CC=CC=C3.C(=O)(C(F)(F)F)O IC50 ~ 50000 nM Poor binder T40103 Cathepsin H BX5GQ6 CID 9821383 Investigative 9821383 C18H29N3O6 383.4 CCCNC(=O)[C@@H]1[C@H](O1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2CCC[C@H]2C(=O)O IC50 ~ 100000 nM Poor binder T40103 Cathepsin H BXL1M8 Chembl346155 Investigative 10770036 C33H43N3O8 609.7 CCOC(=O)[C@@H]1[C@H](N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)OCC3=CC=CC=C3 Ki = 93000 nM Poor binder