BDBM85140 CCK-A Agonist 32
SMILES: COc1ccc(cc1)N(C(C)C)C(=O)CN1c2ccccc2N(c2ccccc2)C(=O)C(Cc2n[nH]c3ccc(F)cc23)C1=O
InChI Key: InChIKey=LJOCWELELLFJSQ-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 85140 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/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)) | BDBM85140
(CCK-A Agonist 32)Show SMILES COc1ccc(cc1)N(C(C)C)C(=O)CN1c2ccccc2N(c2ccccc2)C(=O)C(Cc2n[nH]c3ccc(F)cc23)C1=O Show InChI InChI=1S/C35H32FN5O4/c1-22(2)40(25-14-16-26(45-3)17-15-25)33(42)21-39-31-11-7-8-12-32(31)41(24-9-5-4-6-10-24)35(44)28(34(39)43)20-30-27-19-23(36)13-18-29(27)37-38-30/h4-19,22,28H,20-21H2,1-3H3,(H,37,38) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| 42.7 | 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)) | BDBM85140
(CCK-A Agonist 32)Show SMILES COc1ccc(cc1)N(C(C)C)C(=O)CN1c2ccccc2N(c2ccccc2)C(=O)C(Cc2n[nH]c3ccc(F)cc23)C1=O Show InChI InChI=1S/C35H32FN5O4/c1-22(2)40(25-14-16-26(45-3)17-15-25)33(42)21-39-31-11-7-8-12-32(31)41(24-9-5-4-6-10-24)35(44)28(34(39)43)20-30-27-19-23(36)13-18-29(27)37-38-30/h4-19,22,28H,20-21H2,1-3H3,(H,37,38) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| 2.51E+3 | 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 | |