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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 = 'BDBM50300457'   
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))
BDBM50300457
PNG
(3-(4-chlorophenyl)-N'-(4,4-difluoropiperidin-1-yls...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(F)(F)CC1)N1CCC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:3.3,c:20|
Show InChI InChI=1S/C23H26ClF2N5O2S/c1-27-22(29-34(32,33)30-15-12-23(25,26)13-16-30)31-14-11-20(17-5-3-2-4-6-17)21(28-31)18-7-9-19(24)10-8-18/h2-10,20H,11-16H2,1H3,(H,27,29)
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Similars

Article
PubMed
247n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human CB2 receptor expressed in CHO cells


Bioorg Med Chem Lett 19: 5675-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H
More data for this
Ligand-Target Pair