Found 3 hits Enz. Inhib. hit(s) with Target = 'Gastrin/cholecystokinin type B receptor' and Ligand = 'BDBM85158' Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM85158
(CCK-A Agonist 26)Show SMILES COc1ccc(cc1)N(C(C)C)C(=O)CN1c2ccccc2N(c2ccccc2)C(=O)C(Cc2nn(Cc3ccccc3)c3ccccc23)C1=O Show InChI InChI=1S/C42H39N5O4/c1-29(2)46(32-22-24-33(51-3)25-23-32)40(48)28-44-38-20-12-13-21-39(38)47(31-16-8-5-9-17-31)42(50)35(41(44)49)26-36-34-18-10-11-19-37(34)45(43-36)27-30-14-6-4-7-15-30/h4-25,29,35H,26-28H2,1-3H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| 309 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glaxo Wellcome Research and Development
Curated by PDSP Ki Database
| |
J Med Chem 40: 2706-25 (1997)
Article DOI: 10.1021/jm970265x BindingDB Entry DOI: 10.7270/Q27M06F9 |
More data for this Ligand-Target Pair | |
Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM85158
(CCK-A Agonist 26)Show SMILES COc1ccc(cc1)N(C(C)C)C(=O)CN1c2ccccc2N(c2ccccc2)C(=O)C(Cc2nn(Cc3ccccc3)c3ccccc23)C1=O Show InChI InChI=1S/C42H39N5O4/c1-29(2)46(32-22-24-33(51-3)25-23-32)40(48)28-44-38-20-12-13-21-39(38)47(31-16-8-5-9-17-31)42(50)35(41(44)49)26-36-34-18-10-11-19-37(34)45(43-36)27-30-14-6-4-7-15-30/h4-25,29,35H,26-28H2,1-3H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glaxo Wellcome Research and Development
Curated by PDSP Ki Database
| |
J Med Chem 40: 2706-25 (1997)
Article DOI: 10.1021/jm970265x BindingDB Entry DOI: 10.7270/Q27M06F9 |
More data for this Ligand-Target Pair | |
Gastrin/cholecystokinin type B receptor
(Homo sapiens (Human)) | BDBM85158
(CCK-A Agonist 26)Show SMILES COc1ccc(cc1)N(C(C)C)C(=O)CN1c2ccccc2N(c2ccccc2)C(=O)C(Cc2nn(Cc3ccccc3)c3ccccc23)C1=O Show InChI InChI=1S/C42H39N5O4/c1-29(2)46(32-22-24-33(51-3)25-23-32)40(48)28-44-38-20-12-13-21-39(38)47(31-16-8-5-9-17-31)42(50)35(41(44)49)26-36-34-18-10-11-19-37(34)45(43-36)27-30-14-6-4-7-15-30/h4-25,29,35H,26-28H2,1-3H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 9.99E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Glaxo Wellcome Research and Development
Curated by ChEMBL
| Assay Description Binding affinity against human Cholecystokinin type B receptor by displacement of [125I]CCK-8 |
J Med Chem 39: 2655-8 (1996)
Article DOI: 10.1021/jm960249k BindingDB Entry DOI: 10.7270/Q2JQ126Q |
More data for this Ligand-Target Pair | |