BDBM50035821 Ac-Trp-D-3-MPt(Et)-Asp-Phe-NH2::CHEMBL34916

SMILES: CCS[C@@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O

InChI Key: InChIKey=HCXMHVNDWSXYKX-AFBVCZJXSA-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 = 50035821   

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))	BDBM50035821 (Ac-Trp-D-3-MPt(Et)-Asp-Phe-NH2 | CHEMBL34916) Show SMILES CCS[C@@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O Show InChI InChI=1S/C33H40N6O7S/c1-3-47-27-13-14-39(33(46)26(36-19(2)40)16-21-18-35-23-12-8-7-11-22(21)23)29(27)32(45)38-25(17-28(41)42)31(44)37-24(30(34)43)15-20-9-5-4-6-10-20/h4-12,18,24-27,29,35H,3,13-17H2,1-2H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t24-,25-,26-,27+,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type B receptor by displacement of [125I]-BH-CCK-8 from human jurkat cells				J Med Chem 38: 137-49 (1995) BindingDB Entry DOI: 10.7270/Q2QN65TS
					More data for this Ligand-Target Pair
Cholecystokinin receptor (RAT)	BDBM50035821 (Ac-Trp-D-3-MPt(Et)-Asp-Phe-NH2 | CHEMBL34916) Show SMILES CCS[C@@H]1CCN([C@@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O Show InChI InChI=1S/C33H40N6O7S/c1-3-47-27-13-14-39(33(46)26(36-19(2)40)16-21-18-35-23-12-8-7-11-22(21)23)29(27)32(45)38-25(17-28(41)42)31(44)37-24(30(34)43)15-20-9-5-4-6-10-20/h4-12,18,24-27,29,35H,3,13-17H2,1-2H3,(H2,34,43)(H,36,40)(H,37,44)(H,38,45)(H,41,42)/t24-,25-,26-,27+,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Binding affinity towards Cholecystokinin type A receptor by displacement of [125I]-BH-CCK-8 from rat pancreatic acini				J Med Chem 38: 137-49 (1995) BindingDB Entry DOI: 10.7270/Q2QN65TS
					More data for this Ligand-Target Pair