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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 = 'BDBM50042903'   
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))
BDBM50042903
PNG
(CHEMBL3354562)
Show SMILES Clc1cccc2sc(NC(=O)[C@@H]3CCCCN3C(=O)N3CCS(=O)(=O)CC3)nc12 |r|
Show InChI InChI=1S/C18H21ClN4O4S2/c19-12-4-3-6-14-15(12)20-17(28-14)21-16(24)13-5-1-2-7-23(13)18(25)22-8-10-29(26,27)11-9-22/h3-4,6,13H,1-2,5,7-11H2,(H,20,21,24)/t13-/m0/s1
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Similars

Article
PubMed
n/an/an/an/a 27n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressing CHO cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 3...


Bioorg Med Chem Lett 25: 587-92 (2015)


Article DOI: 10.1016/j.bmcl.2014.12.031
BindingDB Entry DOI: 10.7270/Q2QZ2CM5
More data for this
Ligand-Target Pair