Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50296863'   

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))	BDBM50296863 ((1S,13R)-16-methoxy-22-methyl-10,22-diazahexacyclo...) Show SMILES COc1ccc2C[C@@]34CN(C)CC[C@@]3(Cc3[nH]c5ccccc5c3C4)c2c1 |r| Show InChI InChI=1S/C24H26N2O/c1-26-10-9-24-14-22-19(18-5-3-4-6-21(18)25-22)13-23(24,15-26)12-16-7-8-17(27-2)11-20(16)24/h3-8,11,25H,9-10,12-15H2,1-2H3/t23-,24-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.12E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]U50488 from human kappa opioid receptor expressed in CHO cells				Bioorg Med Chem Lett 19: 4603-6 (2009) Article DOI: 10.1016/j.bmcl.2009.06.093 BindingDB Entry DOI: 10.7270/Q2WQ04RF
					More data for this Ligand-Target Pair