TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T15700	Caspase-8	B12IQX	2-(2,3-Dihydro-1,4-benzodioxin-2-yl)-N,N-dimethyl-1,3-thiazole-4-carboxamide	Investigative	2821634	C14H14N2O3S	290.34	CN(C)C(=O)C1=CSC(=N1)C2COC3=CC=CC=C3O2	IC50 > 200000 nM	Non binder
T15700	Caspase-8	B1WV6Y	(S)-1-(4-(2-(4-Methylphenylsulfonyloxy)ethoxy)benzyl)-5-[1-(2-methoxymethylpyrrolidinyl)sulfonyl]isatin	Investigative	11541867	C30H32N2O9S2	628.7	CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)CN3C4=C(C=C(C=C4)S(=O)(=O)N5CCC[C@H]5COC)C(=O)C3=O	IC50 > 500000 nM	Non binder
T15700	Caspase-8	B2XKR6	Ethyl 2-(2,3-dihydro-1,4-benzodioxin-2-yl)-4-methyl-1,3-thiazole-5-carboxylate	Investigative	2821660	C15H15NO4S	305.4	CCOC(=O)C1=C(N=C(S1)C2COC3=CC=CC=C3O2)C	IC50 > 200000 nM	Non binder
T15700	Caspase-8	B3FX1Q	(S)-1-(4-Iodobenzyl)-5-[1-(2-methoxymethylpyrrolidinyl)sulfonyl]isatin	Investigative	11444079	C21H21IN2O5S	540.4	COC[C@@H]1CCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=C(C=C4)I	IC50 > 500000 nM	Non binder
T15700	Caspase-8	B3T5HN	(S)-1-(4-(2-(4-Methylphenylsulfonyloxy)ethoxy)benzyl)-5-[1-(2-phenoxymethylpyrrolidinyl)sulfonyl]isatin	Investigative	11628992	C35H34N2O9S2	690.8	CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)CN3C4=C(C=C(C=C4)S(=O)(=O)N5CCC[C@H]5COC6=CC=CC=C6)C(=O)C3=O	IC50 > 500000 nM	Non binder
T15700	Caspase-8	B5D0VB	(S)-5-(2-(Methoxymethyl)pyrrolidin-1-ylsulfonyl)-1-methylindoline-2,3-dione	Investigative	11515586	C15H18N2O5S	338.4	CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCC[C@H]3COC)C(=O)C1=O	IC50 > 500000 nM	Non binder
T15700	Caspase-8	B82FSI	(S)-1-(4-Hydroxybenzyl)-5-[1-(2-methoxymethylpyrrolidinyl)-sulfonyl]isatin	Investigative	44417479	C21H22N2O6S	430.5	COC[C@@H]1CCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=C(C=C4)O	IC50 > 500000 nM	Non binder
T15700	Caspase-8	B8OA7E	(S)-5-[1-(2-Methoxymethylpyrrolidinyl)sulfonyl]-1-(4-(tributylstannyl)benzyl)isatin	Investigative	11700402	C33H48N2O5SSn	703.5	CCCC[Sn](CCCC)(CCCC)C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCC[C@H]4COC)C(=O)C2=O	IC50 > 500000 nM	Non binder
T15700	Caspase-8	B8ZSB5	(S)-5-[1-(2-Phenoxymethylpyrrolidinyl)sulfonyl]-1-(4-(tributylstannyl)benzyl)isatin	Investigative	11614728	C38H50N2O5SSn	765.6	CCCC[Sn](CCCC)(CCCC)C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCC[C@H]4COC5=CC=CC=C5)C(=O)C2=O	IC50 > 500000 nM	Non binder
T15700	Caspase-8	B9WXG6	Caspase-3/7 Inhibitor I	Investigative	9840223	C14H16N2O5S	324.35	COC[C@@H]1CCCN1S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C3=O	IC50 > 500000 nM	Non binder
T15700	Caspase-8	BD4WB5	Cys-Gly-Arg-Val-Tyr-Arg-Pro-Cys-Trp-Glu-Val	Investigative	44386296	C60H88N18O15S2	1365.6	CC(C)[C@@H]1C(=O)N[C@H](C(=O)N[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CSSC[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1)CCCN=C(N)N)N)C(=O)N[C@H](CC3=CNC4=CC=CC=C43)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@H](C(C)C)C(=O)O)CCCN=C(N)N)CC5=CC=C(C=C5)O	EC50 = 4000000 nM	Non binder
T15700	Caspase-8	BEGV57	(S)-1-(4-(2-Bromoethoxy)benzyl)-5-[1-(2-phenoxymethylpyrrolidinyl)sulfonyl]isatin	Investigative	11699954	C28H27BrN2O6S	599.5	C1C[C@H](N(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=C(C=C4)OCCBr)COC5=CC=CC=C5	IC50 > 500000 nM	Non binder
T15700	Caspase-8	BH5J1T	(S)-1-(4-(2-Bromoethoxy)benzyl)-5-[1-(2-methoxymethylpyrrolidinyl)sulfonyl]isatin	Investigative	11591919	C23H25BrN2O6S	537.4	COC[C@@H]1CCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=C(C=C4)OCCBr	IC50 > 500000 nM	Non binder
T15700	Caspase-8	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
T15700	Caspase-8	BID16E	(4-Chlorophenyl) 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,3-thiazole-4-carboxylate	Investigative	2821639	C18H12ClNO4S	373.8	C1C(OC2=CC=CC=C2O1)C3=NC(=CS3)C(=O)OC4=CC=C(C=C4)Cl	IC50 > 200000 nM	Non binder
T15700	Caspase-8	BJ80GM	(S)-1-(4-Iodobenzyl)-5-(2-phenoxymethyl-pyrrolidine-1-sulfonyl)isatin	Investigative	11548909	C26H23IN2O5S	602.4	C1C[C@H](N(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=C(C=C4)I)COC5=CC=CC=C5	IC50 > 500000 nM	Non binder
T15700	Caspase-8	BL58WC	[2-(2,3-Dihydro-1,4-benzodioxin-3-yl)-1,3-thiazol-4-yl]-morpholin-4-ylmethanone	Investigative	2821632	C16H16N2O4S	332.4	C1COCCN1C(=O)C2=CSC(=N2)C3COC4=CC=CC=C4O3	IC50 > 200000 nM	Non binder
T15700	Caspase-8	BLIT70	Ala-Met-Val-Gly-Arg-Cys-Tyr-Arg-Pro-Cys-Trp-Glu-Val	Investigative	44384620	C68H102N20O17S3	1567.9	C[C@@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](NC(=O)[C@@H](NC1=O)CC3=CC=C(C=C3)O)CCCN=C(N)N)C(=O)N[C@H](CC4=CNC5=CC=CC=C54)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@H](C(C)C)C(=O)O)N	EC50 = 25000000 nM	Non binder
T15700	Caspase-8	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
T15700	Caspase-8	BOMT23	(S)-1-(4-(Tert-butyldimethylsilyloxy)benzyl)-5-[1-(2-methoxymethylpyrrolidinyl)sulfonyl]isatin	Investigative	11548424	C27H36N2O6SSi	544.7	CC(C)(C)[Si](C)(C)OC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCC[C@H]4COC)C(=O)C2=O	IC50 > 500000 nM	Non binder
T15700	Caspase-8	BQ4F8I	(S)-1-(4-(Tert-butyldimethylsilyloxy)benzyl)-5-[1-(2-phenoxymethylpyrrolidinyl)sulfonyl]isatin	Investigative	11664423	C32H38N2O6SSi	606.8	CC(C)(C)[Si](C)(C)OC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCC[C@H]4COC5=CC=CC=C5)C(=O)C2=O	IC50 > 500000 nM	Non binder
T15700	Caspase-8	BS9QZ5	Asp-Thr-Met-Arg-Ala-Met-Cys-Gly-Arg-Val-Tyr-Arg-Pro-Cys-Trp-Glu-Val	Investigative	73347105	C87H135N27O24S4	2071.4	C[C@H]([C@@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H]1CSSC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC1=O)CCCN=C(N)N)C(C)C)CC3=CC=C(C=C3)O)CCCN=C(N)N)C(=O)N[C@@H](CC4=CNC5=CC=CC=C54)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)[C@H](CC(=O)O)N)O	EC50 = 25000000 nM	Non binder
T15700	Caspase-8	BT95PN	(S)-1-(4-Methoxybenzyl)-5-[1-(2-methoxymethylpyrrolidinyl)-sulfonyl]isatin	Investigative	11510566	C22H24N2O6S	444.5	COC[C@@H]1CCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=C(C=C4)OC	IC50 > 500000 nM	Non binder
T15700	Caspase-8	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
T15700	Caspase-8	BVDH85	2-(2,3-Dihydro-1,4-benzodioxin-2-yl)-4-methyl-1,3-thiazole-5-carboxylic acid	Investigative	2821679	C13H11NO4S	277.3	CC1=C(SC(=N1)C2COC3=CC=CC=C3O2)C(=O)O	IC50 > 200000 nM	Non binder