Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM147191'   

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))	BDBM147191 (US8957084, 4) Show SMILES COc1ccc2C[C@@H]3C4C5CC5C(=C)CC4(CCN3CC3CC3)c2c1 |r,TLB:19:18:6.5.23:8| Show InChI InChI=1S/C23H29NO/c1-14-12-23-7-8-24(13-15-3-4-15)21(22(23)19-11-18(14)19)9-16-5-6-17(25-2)10-20(16)23/h5-6,10,15,18-19,21-22H,1,3-4,7-9,11-13H2,2H3/t18?,19?,21-,22?,23?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.19	-49.4	n/a	n/a	n/a	n/a	n/a	7.4	25
Purdue Pharma L.P. US Patent					Assay Description Radioligand dose displacement assays used 0.4 nM [3H]-U69,593 (GE Healthcare, Piscataway, N.J.; 40 Ci/mmole) with 15 ug membrane protein (recombinant...				US Patent US8957084 (2015) BindingDB Entry DOI: 10.7270/Q21Z433P
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