Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50101325'   

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))	BDBM50101325 (CHEMBL3326351) Show SMILES [H][C@]12O[C@](C)(c3cccc(O)c3)[C@]3([H])O[C@@](C)(c4cccc(O)c4)[C@]([H])(O[C@]1(C)c1cccc(O)c1)N23 |r| Show InChI InChI=1S/C27H27NO6/c1-25(16-7-4-10-19(29)13-16)22-28-23(32-25)26(2,17-8-5-11-20(30)14-17)34-24(28)27(3,33-22)18-9-6-12-21(31)15-18/h4-15,22-24,29-31H,1-3H3/t22-,23-,24-,25-,26+,27+/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>1.00E+3	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				ACS Med Chem Lett 5: 868-72 (2014) Article DOI: 10.1021/ml5000542 BindingDB Entry DOI: 10.7270/Q218388Q
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