Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50271500'   

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))	BDBM50271500 ((3S,6R)-3-Cyclohexyl-7-(3-cyclohexyl-propyl)-6-iso...) Show SMILES CC(C)C[C@@H]1CN2[C@H](C[NH+]=C2N1CCCC1CCCCC1)C1CCCCC1 |r,c:9| Show InChI InChI=1S/C24H43N3/c1-19(2)16-22-18-27-23(21-13-7-4-8-14-21)17-25-24(27)26(22)15-9-12-20-10-5-3-6-11-20/h19-23H,3-18H2,1-2H3/p+1/t22-,23-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.74E+3	n/a	n/a	n/a	n/a	n/a	n/a
Torrey Pines Institute for Molecular Studies Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain homogenate				Bioorg Med Chem 16: 5932-8 (2008) Article DOI: 10.1016/j.bmc.2008.04.061 BindingDB Entry DOI: 10.7270/Q2BG2PW7
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50271500 ((3S,6R)-3-Cyclohexyl-7-(3-cyclohexyl-propyl)-6-iso...) Show SMILES CC(C)C[C@@H]1CN2[C@H](C[NH+]=C2N1CCCC1CCCCC1)C1CCCCC1 |r,c:9| Show InChI InChI=1S/C24H43N3/c1-19(2)16-22-18-27-23(21-13-7-4-8-14-21)17-25-24(27)26(22)15-9-12-20-10-5-3-6-11-20/h19-23H,3-18H2,1-2H3/p+1/t22-,23-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.74E+3	n/a	n/a	n/a	n/a	n/a	n/a
Torrey Pines Institute for Molecular Studies Curated by ChEMBL					Assay Description Inhibitory activity for kappa opioid receptor				J Med Chem 42: 3743-78 (1999) BindingDB Entry DOI: 10.7270/Q22Z167W
					More data for this Ligand-Target Pair