Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50010654'   

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))	BDBM50010654 (CHEMBL3264744) Show SMILES [H][C@]12O[C@]34CC[C@@]5(OCOc6c(O)ccc7C[C@@]3([H])N(CC(C)C)CC[C@]4(c67)[C@]15[H])N(Cc1ccccc1)C2=O |r,TLB:20:19:3:27.15.16,THB:7:6:26:1.2| Show InChI InChI=1S/C30H34N2O5/c1-18(2)15-31-13-12-28-23-20-8-9-21(33)24(23)35-17-36-30-11-10-29(28,22(31)14-20)37-25(26(28)30)27(34)32(30)16-19-6-4-3-5-7-19/h3-9,18,22,25-26,33H,10-17H2,1-2H3/t22-,25+,26+,28+,29-,30+/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	119	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from kappa opioid receptor in guinea pig cerebellum membrane				ACS Med Chem Lett 5: 368-72 (2014) Article DOI: 10.1021/ml400491k BindingDB Entry DOI: 10.7270/Q2GF0W23
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50010654 (CHEMBL3264744) Show SMILES [H][C@]12O[C@]34CC[C@@]5(OCOc6c(O)ccc7C[C@@]3([H])N(CC(C)C)CC[C@]4(c67)[C@]15[H])N(Cc1ccccc1)C2=O |r,TLB:20:19:3:27.15.16,THB:7:6:26:1.2| Show InChI InChI=1S/C30H34N2O5/c1-18(2)15-31-13-12-28-23-20-8-9-21(33)24(23)35-17-36-30-11-10-29(28,22(31)14-20)37-25(26(28)30)27(34)32(30)16-19-6-4-3-5-7-19/h3-9,18,22,25-26,33H,10-17H2,1-2H3/t22-,25+,26+,28+,29-,30+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	333	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Agonist activity at human kappa opioid receptor expressed in HEK293 cells by CellKey method				ACS Med Chem Lett 5: 368-72 (2014) Article DOI: 10.1021/ml400491k BindingDB Entry DOI: 10.7270/Q2GF0W23
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50010654 (CHEMBL3264744) Show SMILES [H][C@]12O[C@]34CC[C@@]5(OCOc6c(O)ccc7C[C@@]3([H])N(CC(C)C)CC[C@]4(c67)[C@]15[H])N(Cc1ccccc1)C2=O |r,TLB:20:19:3:27.15.16,THB:7:6:26:1.2| Show InChI InChI=1S/C30H34N2O5/c1-18(2)15-31-13-12-28-23-20-8-9-21(33)24(23)35-17-36-30-11-10-29(28,22(31)14-20)37-25(26(28)30)27(34)32(30)16-19-6-4-3-5-7-19/h3-9,18,22,25-26,33H,10-17H2,1-2H3/t22-,25+,26+,28+,29-,30+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	760	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as [35S]-GTP[gammaS] binding				ACS Med Chem Lett 5: 368-72 (2014) Article DOI: 10.1021/ml400491k BindingDB Entry DOI: 10.7270/Q2GF0W23
					More data for this Ligand-Target Pair