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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 = 'BDBM50402867'   
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))
BDBM50402867
PNG
(CHEMBL2205589)
Show SMILES COC1CN(C1)C(=O)c1c(NC(=O)c2ccccc2OC(F)(F)F)sc2COCCc12
Show InChI InChI=1S/C20H19F3N2O5S/c1-28-11-8-25(9-11)19(27)16-13-6-7-29-10-15(13)31-18(16)24-17(26)12-4-2-3-5-14(12)30-20(21,22)23/h2-5,11H,6-10H2,1H3,(H,24,26)
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Similars

Article
PubMed
n/an/an/an/a 1.42E+3n/an/an/an/a



Nycomed Pharma Pvt. Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor after 4 hrs by luciferase reporter gene assay


Bioorg Med Chem Lett 22: 7314-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.10.087
BindingDB Entry DOI: 10.7270/Q2QR4Z9V
More data for this
Ligand-Target Pair