Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50166634'   

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))	BDBM50166634 (2-(3-Aminomethyl-phenyl)-N-methyl-N-((S)-1-phenyl-...) Show SMILES CN([C@H](CN1CCCC1)c1ccccc1)C(=O)Cc1cccc(CN)c1 Show InChI InChI=1S/C22H29N3O/c1-24(22(26)15-18-8-7-9-19(14-18)16-23)21(17-25-12-5-6-13-25)20-10-3-2-4-11-20/h2-4,7-11,14,21H,5-6,12-13,15-17,23H2,1H3/t21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibitory constant against human Opioid receptor kappa using [3H]-diprenorphine as radio ligand				Bioorg Med Chem Lett 15: 2647-52 (2005) Article DOI: 10.1016/j.bmcl.2005.03.020 BindingDB Entry DOI: 10.7270/Q2PR7VH4
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50166634 (2-(3-Aminomethyl-phenyl)-N-methyl-N-((S)-1-phenyl-...) Show SMILES CN([C@H](CN1CCCC1)c1ccccc1)C(=O)Cc1cccc(CN)c1 Show InChI InChI=1S/C22H29N3O/c1-24(22(26)15-18-8-7-9-19(14-18)16-23)21(17-25-12-5-6-13-25)20-10-3-2-4-11-20/h2-4,7-11,14,21H,5-6,12-13,15-17,23H2,1H3/t21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	15	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Agonist activity assessed by ability to stimulate [35S]GTP gammaS binding to opioid receptor kappa in human membranes				Bioorg Med Chem Lett 15: 2647-52 (2005) Article DOI: 10.1016/j.bmcl.2005.03.020 BindingDB Entry DOI: 10.7270/Q2PR7VH4
					More data for this Ligand-Target Pair