Compile Data Set for Download or QSAR
Found 3 Enz. Inhib. hit(s) with all data for entry = 50008085
TargetDipeptidyl peptidase 4(Homo sapiens (Human))
Tanabe Seiyaku Co., Ltd

Curated by ChEMBL
LigandPNGBDBM50070542((3S)-N-(L-Tryptophanyl)-1,2,3,4-tetrahydroisoquino...)
Show SMILES N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1Cc2ccccc2C[C@H]1C(O)=O
Show InChI InChI=1S/C21H21N3O3/c22-17(9-15-11-23-18-8-4-3-7-16(15)18)20(25)24-12-14-6-2-1-5-13(14)10-19(24)21(26)27/h1-8,11,17,19,23H,9-10,12,22H2,(H,26,27)/t17-,19-/m0/s1
Affinity DataIC50: 5.70E+3nMAssay Description:Inhibitory concentration of the compound against Dipeptidyl peptidase IV (DPP IV)More data for this Ligand-Target Pair
TargetDipeptidyl peptidase 4(Homo sapiens (Human))
Tanabe Seiyaku Co., Ltd

Curated by ChEMBL
LigandPNGBDBM50070543((S)-2-({(S)-2-[(S)-2-Amino-3-(1H-indol-3-yl)-propi...)
Show SMILES N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](CCC(O)=O)C(O)=O
Show InChI InChI=1S/C26H28N4O6/c27-19(11-17-13-28-20-8-4-3-7-18(17)20)25(34)30-14-16-6-2-1-5-15(16)12-22(30)24(33)29-21(26(35)36)9-10-23(31)32/h1-8,13,19,21-22,28H,9-12,14,27H2,(H,29,33)(H,31,32)(H,35,36)/t19-,21-,22-/m0/s1
Affinity DataIC50: 7.00E+3nMAssay Description:Inhibitory concentration of the compound against Dipeptidyl peptidase IV (DPP IV)More data for this Ligand-Target Pair
TargetDipeptidyl peptidase 4(Homo sapiens (Human))
Tanabe Seiyaku Co., Ltd

Curated by ChEMBL
LigandPNGBDBM50070544((S)-2-({(S)-2-[(S)-2-Amino-3-(1H-indol-3-yl)-propi...)
Show SMILES N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](CO)C(O)=O
Show InChI InChI=1S/C24H26N4O5/c25-18(9-16-11-26-19-8-4-3-7-17(16)19)23(31)28-12-15-6-2-1-5-14(15)10-21(28)22(30)27-20(13-29)24(32)33/h1-8,11,18,20-21,26,29H,9-10,12-13,25H2,(H,27,30)(H,32,33)/t18-,20-,21-/m0/s1
Affinity DataIC50: 7.90E+3nMAssay Description:Inhibitory concentration of the compound against Dipeptidyl peptidase IV (DPP IV)More data for this Ligand-Target Pair