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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 = 'BDBM50334046'   
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))
BDBM50334046
PNG
(1-(3-(4-(2-fluoro-5-methoxyphenyl)-1H-imidazol-2-y...)
Show SMILES COc1ccc(F)c(c1)-c1c[nH]c(n1)-c1cccc(CN2CCCCC2)c1
Show InChI InChI=1S/C22H24FN3O/c1-27-18-8-9-20(23)19(13-18)21-14-24-22(25-21)17-7-5-6-16(12-17)15-26-10-3-2-4-11-26/h5-9,12-14H,2-4,10-11,15H2,1H3,(H,24,25)
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Similars

Article
PubMed
n/an/an/an/a 320n/an/an/an/a



Merck Research Laboratory

Curated by ChEMBL


Assay Description
Agonist activity at human cloned CB1 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation


Bioorg Med Chem Lett 21: 182-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.044
BindingDB Entry DOI: 10.7270/Q20P108G
More data for this
Ligand-Target Pair