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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50023631'   
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
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50023631
PNG
(CHEMBL3341872)
Show SMILES Clc1ccc(NC(=O)Nc2cccc(c2)-c2cccc(NC3CCCC3)n2)cc1
Show InChI InChI=1S/C23H23ClN4O/c24-17-11-13-19(14-12-17)26-23(29)27-20-8-3-5-16(15-20)21-9-4-10-22(28-21)25-18-6-1-2-7-18/h3-5,8-15,18H,1-2,6-7H2,(H,25,28)(H2,26,27,29)
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Article
PubMed
n/an/a 501n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human CB1 receptor stably expressed in RD-HGA16 cells assessed as inhibition of CP55,940-induced calcium mobilization after 15...


J Med Chem 57: 7758-69 (2014)


Article DOI: 10.1021/jm501042u
BindingDB Entry DOI: 10.7270/Q26W9CNX
More data for this
Ligand-Target Pair