TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T68290	Cathepsin S	B2UH7L	Tert-butyl N-{[(cyanomethyl)carbamoyl]methyl}carbamate	Investigative	14060550	C9H15N3O3	213.23	CC(C)(C)OC(=O)NCC(=O)NCC#N	Ki > 1000000 nM	Non binder
T68290	Cathepsin S	B57BQX	Morpholine-4-carboxylic acid [3-methyl-1-(1-methyl-3-phenyl-propylcarbamoyl)-butyl]-amide	Investigative	11783702	C21H33N3O3	375.5	C[C@H](CCC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)NC(=O)N2CCOCC2	IC50 > 339000 nM	Non binder
T68290	Cathepsin S	B8IW1R	Carbamic acid, [2-[(cyanomethyl)amino]-1-methyl-2-oxoethyl]-, 1,1-dimethylethyl ester, (s)-	Investigative	15283376	C10H17N3O3	227.26	C[C@@H](C(=O)NCC#N)NC(=O)OC(C)(C)C	Ki = 292000 nM	Non binder
T68290	Cathepsin S	BHFZ92	8-Mercaptocaffeine	Investigative	764318	C8H10N4O2S	226.26	CN1C2=C(NC1=S)N(C(=O)N(C2=O)C)C	IC50 > 200000 nM	Non binder
T68290	Cathepsin S	BO3K2C	1-Benzyl-3,7-dimethyl-8-sulfanylidene-9H-purine-2,6-dione	Investigative	3708081	C14H14N4O2S	302.35	CN1C2=C(NC1=S)N(C(=O)N(C2=O)CC3=CC=CC=C3)C	IC50 > 200000 nM	Non binder
T68290	Cathepsin S	BU58ET	Dipeptide-derived nitrile, 2	Investigative	15567852	C12H13N3O3	247.25	C1=CC=C(C=C1)COC(=O)NCC(=O)NCC#N	Ki > 1000000 nM	Non binder
T68290	Cathepsin S	BUY3N7	1-Ethyl-8-mercapto-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione	Investigative	45496892	C9H12N4O2S	240.28	CCN1C(=O)C2=C(NC(=S)N2C)N(C1=O)C	IC50 > 200000 nM	Non binder
T68290	Cathepsin S	BWON84	7-[3-(4-Chlorophenoxy)-2-hydroxypropyl]-3-methyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione	Investigative	3107941	C15H15ClN4O4S	382.8	CN1C2=C(C(=O)NC1=O)N(C(=S)N2)CC(COC3=CC=C(C=C3)Cl)O	IC50 > 200000 nM	Non binder