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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 = 'BDBM50226267'   
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))
BDBM50226267
PNG
(6-(2-(2-morpholinoethyl)-2,3,4,5-tetrahydro-1H-ben...)
Show SMILES NC(=O)c1ccc(Oc2ccc3CN(CCN4CCOCC4)CCCc3c2)nc1
Show InChI InChI=1S/C22H28N4O3/c23-22(27)18-4-6-21(24-15-18)29-20-5-3-19-16-26(7-1-2-17(19)14-20)9-8-25-10-12-28-13-11-25/h3-6,14-15H,1-2,7-13,16H2,(H2,23,27)
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Article
PubMed
360n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from cloned human kappa opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 17: 6841-6 (2007)


Article DOI: 10.1016/j.bmcl.2007.10.025
BindingDB Entry DOI: 10.7270/Q2125TGQ
More data for this
Ligand-Target Pair