BDBM50357059 CHEMBL1917058

SMILES: CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCCCN=[N+]=[N-])C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O

InChI Key: InChIKey=DZZOGWDZOKEVMN-DZUOILHNSA-N

Data: 1 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50357059   

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))	BDBM50357059 (CHEMBL1917058) Show SMILES CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCCCN=[N+]=[N-])C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C35H45N9O7S/c1-52-17-15-26(33(49)43-29(20-31(46)47)35(51)42-27(32(36)48)18-22-10-4-2-5-11-22)41-34(50)28(40-30(45)14-6-3-9-16-39-44-37)19-23-21-38-25-13-8-7-12-24(23)25/h2,4-5,7-8,10-13,21,26-29,38H,3,6,9,14-20H2,1H3,(H2,36,48)(H,40,45)(H,41,50)(H,42,51)(H,43,49)(H,46,47)/t26-,27-,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Arizona Curated by ChEMBL					Assay Description Displacement of Eu-DTAP-CCK8-NH2 from CCK2 receptor expressed in human HEK293 cells after 1 hr by time resolved fluorescence method				Bioorg Med Chem 19: 6474-82 (2011) Article DOI: 10.1016/j.bmc.2011.08.053 BindingDB Entry DOI: 10.7270/Q2PZ5977
					More data for this Ligand-Target Pair