Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50283517'   

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))	BDBM50283517 (10-(3-furyl)-4-methyl-(1S,5R,13R,14S,17R)-12-oxa-4...) Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5-c1ccoc1 |c:16| Show InChI InChI=1S/C21H21NO3/c1-22-8-7-21-15-4-5-17(23)20(21)25-19-14(13-6-9-24-11-13)3-2-12(18(19)21)10-16(15)22/h2-6,9,11,15-17,20,23H,7-8,10H2,1H3/t15-,16+,17-,20-,21-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding to kappa opioid receptor by using [3H]-U-69,593 as radioligand in guinea pig cerebellum				Bioorg Med Chem Lett 4: 2527-2532 (1994) Article DOI: 10.1016/S0960-894X(01)80277-8 BindingDB Entry DOI: 10.7270/Q2V124R0
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