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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 = 'BDBM50265684'   
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))
BDBM50265684
PNG
(CHEMBL496371 | N'-[(3Z)-1-(Cyclohexylmethyl)-6-met...)
Show SMILES COc1ccc2C(=NNC(=O)C3CCCCC3)C(=O)N(CC3CCCCC3)c2c1 |w:7.7|
Show InChI InChI=1S/C23H31N3O3/c1-29-18-12-13-19-20(14-18)26(15-16-8-4-2-5-9-16)23(28)21(19)24-25-22(27)17-10-6-3-7-11-17/h12-14,16-17H,2-11,15H2,1H3,(H,25,27)
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Article
PubMed
n/an/an/an/a 71.6n/an/an/an/a



The University of Texas M. D. Anderson Cancer Center

Curated by ChEMBL


Assay Description
Inverse agonist activity at human recombinant CB2 receptor expressed CHO cells membrane by [35S]GTPgamma binding assay


J Med Chem 52: 433-44 (2009)


Article DOI: 10.1021/jm801353p
BindingDB Entry DOI: 10.7270/Q20G3M2X
More data for this
Ligand-Target Pair