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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 = 'BDBM50023913'   
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))
BDBM50023913
PNG
(CHEMBL2112649)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2cc[nH]c2c1
Show InChI InChI=1S/C24H30N4O/c1-3-27(4-2)24(29)20-8-6-19(7-9-20)23(28-15-13-25-14-16-28)21-10-5-18-11-12-26-22(18)17-21/h5-12,17,23,25-26H,3-4,13-16H2,1-2H3
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PubMed
n/an/a 3.97E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)


BindingDB Entry DOI: 10.7270/Q2QN661W
More data for this
Ligand-Target Pair