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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 = 'BDBM50495631'   
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))
BDBM50495631
PNG
(CHEMBL3114343)
Show SMILES Fc1ccc(Cn2cc(\C=C\c3ccccc3)cc(C(=O)NC3CCCCCC3)c2=O)cc1
Show InChI InChI=1S/C28H29FN2O2/c29-24-16-14-22(15-17-24)19-31-20-23(13-12-21-8-4-3-5-9-21)18-26(28(31)33)27(32)30-25-10-6-1-2-7-11-25/h3-5,8-9,12-18,20,25H,1-2,6-7,10-11,19H2,(H,30,32)/b13-12+
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PC cid
PC sid
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Article
PubMed
7.90n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 74: 524-32 (2014)


Article DOI: 10.1016/j.ejmech.2013.10.070
BindingDB Entry DOI: 10.7270/Q21V5HXR
More data for this
Ligand-Target Pair