Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50108453'   

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))	BDBM50108453 (5-(3,4-Dichloro-phenyl)-1-(1-phenyl-2-pyrrolidin-1...) Show SMILES Clc1ccc(cc1Cl)-c1ccc(=O)n(c1)C(CN1CCCC1)c1ccccc1 Show InChI InChI=1S/C23H22Cl2N2O/c24-20-10-8-18(14-21(20)25)19-9-11-23(28)27(15-19)22(16-26-12-4-5-13-26)17-6-2-1-3-7-17/h1-3,6-11,14-15,22H,4-5,12-13,16H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.49E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Mölndal Curated by ChEMBL					Assay Description Binding affinity towards kappa opioid receptor by the displacement of [125I]-(D-Pro10)-Dynorphin A				Bioorg Med Chem Lett 12: 197-200 (2001) BindingDB Entry DOI: 10.7270/Q28051XH
					More data for this Ligand-Target Pair