Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50136592'   

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))	BDBM50136592 (3-((3R,4R)-1-Benzofuran-2-ylmethyl-3,4-dimethyl-pi...) Show SMILES C[C@H]1CN(Cc2cc3ccccc3o2)CC[C@@]1(C)c1cccc(c1)C(N)=O Show InChI InChI=1S/C23H26N2O2/c1-16-14-25(15-20-13-17-6-3-4-9-21(17)27-20)11-10-23(16,2)19-8-5-7-18(12-19)22(24)26/h3-9,12-13,16H,10-11,14-15H2,1-2H3,(H2,24,26)/t16-,23+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Binding affinity at cloned human kappa opioid receptor by [3H]diprenorphine displacement.				Bioorg Med Chem Lett 13: 4459-62 (2003) BindingDB Entry DOI: 10.7270/Q2RV0P7G
					More data for this Ligand-Target Pair