Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50092517'   

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))	BDBM50092517 (3-{[(Carboxy-phenyl-methyl)-methyl-amino]-phenyl-m...) Show SMILES CN1CC2(C(N(C)C(c3ccccc3)C(C1)(C(O)=O)C2=O)c1ccccc1)C(O)=O |TLB:6:5:19:1.15.2,21:4:19:1.15.2,8:7:19:1.15.2| Show InChI InChI=1S/C23H24N2O5/c1-24-13-22(20(27)28)17(15-9-5-3-6-10-15)25(2)18(16-11-7-4-8-12-16)23(14-24,19(22)26)21(29)30/h3-12,17-18H,13-14H2,1-2H3,(H,27,28)(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Würzburg Curated by ChEMBL					Assay Description Inhibition against [3H]-diprenorphine human Opioid receptor kappa 1 at 10 micromol/L				J Med Chem 43: 3746-51 (2000) BindingDB Entry DOI: 10.7270/Q2H41QPP
					More data for this Ligand-Target Pair