TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T07403	Integrin alpha-4/beta-7	B0E3OP	(S)-2-(2-Methoxy-benzylamino)-3-phenyl-propionic acid tert-butyl ester	Investigative	12968381	C21H27NO3	341.4	CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NCC2=CC=CC=C2OC	IC50 = 50000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	B0U8NM	(S)-2-(3-Fluoro-benzylamino)-3-phenyl-propionic acid tert-butyl ester	Investigative	44284375	C20H24FNO2	329.4	CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NCC2=CC(=CC=C2)F	IC50 = 176000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	B1XLE3	22-Amino-19-(3-guanidino-propyl)-10-(1-hydroxy-ethyl)-16-hydroxymethyl-7-isobutyl-13-methyl-6,9,12,15,18,21-hexaoxo-1,2-dithia-5,8,11,14,17,20-hexaaza-cyclotricosane-4-carboxylic acid amide	Investigative	44343326	C28H51N11O9S2	749.9	C[C@@H]1C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](CSSC[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)CO)CCCN=C(N)N)N)C(=O)N)CC(C)C)[C@@H](C)O	IC50 ~ 100000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	B2N8RG	(S)-2-Benzylamino-3-phenyl-propionic acid tert-butyl ester	Investigative	10710179	C20H25NO2	311.4	CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NCC2=CC=CC=C2	IC50 = 100000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	B3QA6H	(S)-2-(4-Methoxy-benzylamino)-3-phenyl-propionic acid tert-butyl ester	Investigative	10545196	C21H27NO3	341.4	CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NCC2=CC=C(C=C2)OC	IC50 = 122000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	B52DWA	(S)-3-(3,4-Dimethoxy-phenyl)-3-[2-((3-methoxy-propyl)-{2-[4-(3-o-tolyl-ureido)-phenyl]-acetyl}-amino)-acetylamino]-propionic acid	Investigative	9852055	C33H40N4O8	620.7	CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)CC(=O)N(CCCOC)CC(=O)N[C@@H](CC(=O)O)C3=CC(=C(C=C3)OC)OC	IC50 ~ 100000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	B7UEZ6	(S)-2-(4-Fluoro-benzylamino)-3-phenyl-propionic acid tert-butyl ester	Investigative	44284066	C20H24FNO2	329.4	CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NCC2=CC=C(C=C2)F	IC50 = 121000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	B7WG3E	(S)-2-(2-Hydroxy-benzylamino)-3-phenyl-propionic acid tert-butyl ester	Investigative	12968383	C20H25NO3	327.4	CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NCC2=CC=CC=C2O	IC50 = 60000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BB1F4V	(S)-3-[2-((3-Methoxy-propyl)-{2-[4-(3-o-tolyl-ureido)-phenyl]-acetyl}-amino)-acetylamino]-3-phenyl-propionic acid	Investigative	9807891	C31H36N4O6	560.6	CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)CC(=O)N(CCCOC)CC(=O)N[C@@H](CC(=O)O)C3=CC=CC=C3	IC50 ~ 100000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BCF1G8	(S)-2-(4-Hydroxy-benzylamino)-3-phenyl-propionic acid tert-butyl ester	Investigative	12968384	C20H25NO3	327.4	CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NCC2=CC=C(C=C2)O	IC50 = 85000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BD3K7N	2-[(4S,7R,10S,13S,16S,19R,22S)-22-Amino-4-carbamoyl-19-[3-(diaminomethylideneamino)propyl]-10-[(1S)-1-hydroxyethyl]-16-(hydroxymethyl)-7-(2-methylpropyl)-6,9,12,15,18,21-hexaoxo-1,2-dithia-5,8,11,14,17,20-hexazacyclotricos-13-yl]acetic acid	Investigative	56671702	C29H51N11O11S2	793.9	C[C@@H]([C@H]1C(=O)N[C@@H](C(=O)N[C@H](CSSC[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(=O)O)CO)CCCN=C(N)N)N)C(=O)N)CC(C)C)O	IC50 ~ 100000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BG54PR	(S)-2-(3-Hydroxy-benzylamino)-3-phenyl-propionic acid tert-butyl ester	Investigative	12968380	C20H25NO3	327.4	CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NCC2=CC(=CC=C2)O	IC50 = 54000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BJUH80	22-Amino-13-(2-carbamoyl-ethyl)-19-(3-guanidino-propyl)-10-(1-hydroxy-ethyl)-16-hydroxymethyl-7-isobutyl-6,9,12,15,18,21-hexaoxo-1,2-dithia-5,8,11,14,17,20-hexaaza-cyclotricosane-4-carboxylic acid amide	Investigative	44343621	C30H54N12O10S2	807	C[C@H]([C@H]1C(=O)N[C@@H](C(=O)N[C@H](CSSC[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N1)CCC(=O)N)CO)CCCN=C(N)N)N)C(=O)N)CC(C)C)O	IC50 ~ 100000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BKDA49	2-[(3R,6S,9R,12S,15R,18R)-15-Benzyl-3-(carboxymethyl)-6-[(1R)-1-hydroxyethyl]-12-(2-methylpropyl)-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,16-hexazabicyclo[16.3.0]henicosan-9-yl]acetic acid	Investigative	44321087	C32H44N6O11	688.7	C[C@H]([C@H]1C(=O)N[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N1)CC(=O)O)CC(C)C)CC3=CC=CC=C3)CC(=O)O)O	IC50 = 163000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BN4YW7	(E)-(S)-3-[2-((3-Methoxy-propyl)-{2-[4-(3-o-tolyl-ureido)-phenyl]-acetyl}-amino)-acetylamino]-hex-4-enoic acid	Investigative	9849697	C28H36N4O6	524.6	C/C=C/[C@H](CC(=O)O)NC(=O)CN(CCCOC)C(=O)CC1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2C	IC50 ~ 100000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BN9L6B	(S)-2-(2-Hydroxy-5-nitro-benzylamino)-3-phenyl-propionic acid 3-methyl-but-3-enyl ester	Investigative	12968385	C21H24N2O5	384.4	CC(=C)CCOC(=O)[C@H](CC1=CC=CC=C1)NCC2=C(C=CC(=C2)[N+](=O)[O-])O	IC50 = 82000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BP8E6W	(S)-2-(2-Fluoro-benzylamino)-3-phenyl-propionic acid tert-butyl ester	Investigative	44284064	C20H24FNO2	329.4	CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NCC2=CC=CC=C2F	IC50 = 117000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BV3Z5S	(S)-2-((S)-4-Methyl-2-{2-[4-(3-o-tolyl-ureido)-phenyl]-acetylamino}-pentanoylamino)-succinic acid	Investigative	11799915	C26H32N4O7	512.6	CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O	IC50 = 59000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BX50YN	22-Amino-13-carbamoylmethyl-19-(3-guanidino-propyl)-10-(1-hydroxy-ethyl)-16-hydroxymethyl-7-isobutyl-6,9,12,15,18,21-hexaoxo-1,2-dithia-5,8,11,14,17,20-hexaaza-cyclotricosane-4-carboxylic acid amide	Investigative	44343657	C29H52N12O10S2	792.9	C[C@H]([C@H]1C(=O)N[C@@H](C(=O)N[C@H](CSSC[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N1)CC(=O)N)CO)CCCN=C(N)N)N)C(=O)N)CC(C)C)O	IC50 = 175000 nM	Poor binder
T07403	Integrin alpha-4/beta-7	BYF1Q8	(S)-2-(3-Methoxy-benzylamino)-3-phenyl-propionic acid tert-butyl ester	Investigative	12968382	C21H27NO3	341.4	CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NCC2=CC(=CC=C2)OC	IC50 = 122000 nM	Poor binder