Compile Data Set for Download or QSAR
Found 2 of ic50 for monomerid = 50057305
TargetGastrin/cholecystokinin type B receptor(Homo sapiens (Human))
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50057305(3-{(S)-2-[2-tert-Butoxycarbonylamino-3-(1H-indol-3...)
Show SMILES CC(C)(C)OC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccc(cc1)[N+]([O-])=O)C(=O)NC(CC(O)=O)C(=O)NC(Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C42H51N9O11/c1-42(2,3)62-41(59)50-33(22-26-24-45-30-14-8-7-13-29(26)30)38(56)47-31(15-9-10-20-44-40(58)46-27-16-18-28(19-17-27)51(60)61)37(55)49-34(23-35(52)53)39(57)48-32(36(43)54)21-25-11-5-4-6-12-25/h4-8,11-14,16-19,24,31-34,45H,9-10,15,20-23H2,1-3H3,(H2,43,54)(H,47,56)(H,48,57)(H,49,55)(H,50,59)(H,52,53)(H2,44,46,58)/t31-,32?,33?,34?/m0/s1
Affinity DataIC50: 31nMAssay Description:Displacement of [125I]- BH-CCK-8 from Cholecystokinin type B receptor of guinea pig cortexMore data for this Ligand-Target Pair
TargetCholecystokinin receptor type A(Cavia porcellus)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50057305(3-{(S)-2-[2-tert-Butoxycarbonylamino-3-(1H-indol-3...)
Show SMILES CC(C)(C)OC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)Nc1ccc(cc1)[N+]([O-])=O)C(=O)NC(CC(O)=O)C(=O)NC(Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C42H51N9O11/c1-42(2,3)62-41(59)50-33(22-26-24-45-30-14-8-7-13-29(26)30)38(56)47-31(15-9-10-20-44-40(58)46-27-16-18-28(19-17-27)51(60)61)37(55)49-34(23-35(52)53)39(57)48-32(36(43)54)21-25-11-5-4-6-12-25/h4-8,11-14,16-19,24,31-34,45H,9-10,15,20-23H2,1-3H3,(H2,43,54)(H,47,56)(H,48,57)(H,49,55)(H,50,59)(H,52,53)(H2,44,46,58)/t31-,32?,33?,34?/m0/s1
Affinity DataIC50: 41nMAssay Description:Displacement of [125I]- BH-CCK-8 from Cholecystokinin type A receptor of guinea pig pancreasMore data for this Ligand-Target Pair