Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50045739'   

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 (Cavia porcellus (domestic guinea pig))	BDBM50045739 (3-[3,4-Dimethyl-1-(2-m-tolyl-ethyl)-piperidin-4-yl...) Show SMILES C[C@H]1CN(CCc2cccc(C)c2)CC[C@@]1(C)c1cccc(O)c1 Show InChI InChI=1S/C22H29NO/c1-17-6-4-7-19(14-17)10-12-23-13-11-22(3,18(2)16-23)20-8-5-9-21(24)15-20/h4-9,14-15,18,24H,10-13,16H2,1-3H3/t18-,22+/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	35	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Binding affinity towards kappa-opioid receptor by displacement of [3H]-EKC at 10 nM from guinea pig cortical tissue				J Med Chem 36: 2833-41 (1993) BindingDB Entry DOI: 10.7270/Q2W0951M
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50045739 (3-[3,4-Dimethyl-1-(2-m-tolyl-ethyl)-piperidin-4-yl...) Show SMILES C[C@H]1CN(CCc2cccc(C)c2)CC[C@@]1(C)c1cccc(O)c1 Show InChI InChI=1S/C22H29NO/c1-17-6-4-7-19(14-17)10-12-23-13-11-22(3,18(2)16-23)20-8-5-9-21(24)15-20/h4-9,14-15,18,24H,10-13,16H2,1-3H3/t18-,22+/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	82	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Binding affinity towards kappa-opioid receptor by displacement of [3H]-EKC at 100 nM from guinea pig cortical tissue				J Med Chem 36: 2833-41 (1993) BindingDB Entry DOI: 10.7270/Q2W0951M
					More data for this Ligand-Target Pair