Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50302770'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50302770 (4-((1-(2-(1H-imidazol-2-yl)ethyl)piperidin-4-yl)(3...) Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(CCc2ncc[nH]2)CC1)c1cccc(OC)c1 Show InChI InChI=1S/C28H37N5O2/c1-4-32(5-2)28(34)22-9-11-23(12-10-22)33(25-7-6-8-26(21-25)35-3)24-13-18-31(19-14-24)20-15-27-29-16-17-30-27/h6-12,16-17,21,24H,4-5,13-15,18-20H2,1-3H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Montr£al Curated by ChEMBL					Assay Description Displacement of [125I]D-pro10-dynorphin from human cloned kappa opioid receptor				Bioorg Med Chem Lett 19: 5994-8 (2009) Article DOI: 10.1016/j.bmcl.2009.09.072 BindingDB Entry DOI: 10.7270/Q22J6BX8
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