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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50205159'   
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 2


(Homo sapiens (Human))
BDBM50205159
PNG
(CHEMBL230825 | biphenyl-4-sulfonic acid [(1S,2S)-3...)
Show SMILES C[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccccc1)[C@@H](Cc1ccc(Cl)cc1)c1cccc(c1)C#N
Show InChI InChI=1S/C29H25ClN2O2S/c1-21(32-35(33,34)28-16-12-25(13-17-28)24-7-3-2-4-8-24)29(19-22-10-14-27(30)15-11-22)26-9-5-6-23(18-26)20-31/h2-18,21,29,32H,19H2,1H3/t21-,29+/m0/s1
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Article
PubMed
n/an/a 406n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human recombinant CB2 receptor expressed in CHO cells


Bioorg Med Chem Lett 17: 2184-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.087
BindingDB Entry DOI: 10.7270/Q2HM584G
More data for this
Ligand-Target Pair