BDBM50037863 2-{(3R,5R)-3-[3-(3-Chloro-phenyl)-ureido]-2-oxo-5-phenyl-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl}-N-(1-methyl-cyclohexyl)-acetamide::CHEMBL124611

SMILES: CC1(CCCCC1)NC(=O)CN1c2ccccc2[C@H](C[C@@H](NC(=O)Nc2cccc(Cl)c2)C1=O)c1ccccc1

InChI Key: InChIKey=RKKAWDULAQHRCY-KAYWLYCHSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50037863   

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))	BDBM50037863 (2-{(3R,5R)-3-[3-(3-Chloro-phenyl)-ureido]-2-oxo-5-...) Show SMILES CC1(CCCCC1)NC(=O)CN1c2ccccc2[C@H](C[C@@H](NC(=O)Nc2cccc(Cl)c2)C1=O)c1ccccc1 Show InChI InChI=1S/C32H35ClN4O3/c1-32(17-8-3-9-18-32)36-29(38)21-37-28-16-7-6-15-25(28)26(22-11-4-2-5-12-22)20-27(30(37)39)35-31(40)34-24-14-10-13-23(33)19-24/h2,4-7,10-16,19,26-27H,3,8-9,17-18,20-21H2,1H3,(H,36,38)(H2,34,35,40)/t26-,27-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description In vitro affinity to the cholecystokinin type B receptor in guinea pig cortex assayed using [125I]-BH-CCK-8 as radioligand				J Med Chem 37: 3789-811 (1994) BindingDB Entry DOI: 10.7270/Q2KK99TN
					More data for this Ligand-Target Pair
Cholecystokinin receptor type A (Cavia porcellus)	BDBM50037863 (2-{(3R,5R)-3-[3-(3-Chloro-phenyl)-ureido]-2-oxo-5-...) Show SMILES CC1(CCCCC1)NC(=O)CN1c2ccccc2[C@H](C[C@@H](NC(=O)Nc2cccc(Cl)c2)C1=O)c1ccccc1 Show InChI InChI=1S/C32H35ClN4O3/c1-32(17-8-3-9-18-32)36-29(38)21-37-28-16-7-6-15-25(28)26(22-11-4-2-5-12-22)20-27(30(37)39)35-31(40)34-24-14-10-13-23(33)19-24/h2,4-7,10-16,19,26-27H,3,8-9,17-18,20-21H2,1H3,(H,36,38)(H2,34,35,40)/t26-,27-/m1/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	467	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description In vitro binding affinity for the cholecystokinin type A receptor in guinea pig pancreas assayed using [125I]-BH-CCK-8 as radioligand				J Med Chem 37: 3789-811 (1994) BindingDB Entry DOI: 10.7270/Q2KK99TN
					More data for this Ligand-Target Pair