BDBM50043559 1-[1-(3-Chloro-2-hydroxy-propyl)-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl]-3-(4-chloro-phenyl)-urea::CHEMBL337286

SMILES: O[C@@H](CCl)CN1c2ccccc2C(=NC(NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1

InChI Key: InChIKey=HXXRJVJGNWSUJW-HSTJUUNISA-N

Data: 1 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 1 hit for monomerid = 50043559   

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
Cholecystokinin receptor (Homo sapiens (Human))	BDBM50043559 (1-[1-(3-Chloro-2-hydroxy-propyl)-2-oxo-5-phenyl-2,...) Show SMILES O[C@@H](CCl)CN1c2ccccc2C(=NC(NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1 |c:13| Show InChI InChI=1S/C25H22Cl2N4O3/c26-14-19(32)15-31-21-9-5-4-8-20(21)22(16-6-2-1-3-7-16)29-23(24(31)33)30-25(34)28-18-12-10-17(27)11-13-18/h1-13,19,23,32H,14-15H2,(H2,28,30,34)/t19-,23?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of binding of [125I]-CCK-8 to the cholecystokinin type B receptor				J Med Chem 36: 4276-92 (1994) BindingDB Entry DOI: 10.7270/Q22J6CH9
					More data for this Ligand-Target Pair