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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 = 'BDBM50364097'   
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))
BDBM50364097
PNG
(CHEMBL1950923)
Show SMILES CCS(=O)(=O)c1ccc2n(CC3CCN(CC3)C(C)=O)c(nc2c1)C(C)(C)C
Show InChI InChI=1S/C21H31N3O3S/c1-6-28(26,27)17-7-8-19-18(13-17)22-20(21(3,4)5)24(19)14-16-9-11-23(12-10-16)15(2)25/h7-8,13,16H,6,9-12,14H2,1-5H3
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Similars

Article
PubMed
n/an/an/an/a 8.40n/an/an/an/a



Janssen Research& Development

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor


Bioorg Med Chem Lett 22: 547-52 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.091
BindingDB Entry DOI: 10.7270/Q2JW8FBF
More data for this
Ligand-Target Pair