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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50340695'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Kappa-type opioid receptor


(Homo sapiens (Human))		BDBM50340695
PNG
(CHEMBL1762399 | N-(4-amino-2-methylquinolin-6-yl)-...)
Show SMILES CCCCCNCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1
Show InChI InChI=1S/C30H34N4O2/c1-3-4-7-16-32-19-22-10-13-25(14-11-22)36-20-23-8-5-6-9-26(23)30(35)34-24-12-15-29-27(18-24)28(31)17-21(2)33-29/h5-6,8-15,17-18,32H,3-4,7,16,19-20H2,1-2H3,(H2,31,33)(H,34,35)
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Similars
Article
PubMed
n/an/a 3.67E+3n/an/an/an/an/an/a



Istituto Superiore di Sanit£

Curated by ChEMBL


Assay Description
Displacement of [3H]-naltrindole from human kappa opioid receptor expressed in human HEK293 cells after 2 hrs by scintillation counting

Eur J Med Chem 46: 1207-21 (2011)


Article DOI: 10.1016/j.ejmech.2011.01.040
BindingDB Entry DOI: 10.7270/Q2NK3FBC
More data for this
Ligand-Target Pair