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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 = 'BDBM50334015'   
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))
BDBM50334015
PNG
(1-(2-(3-(morpholinomethyl)phenyl)-4-(3-(trifluorom...)
Show SMILES CC(=O)n1cc(nc1-c1cccc(CN2CCOCC2)c1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C23H22F3N3O2/c1-16(30)29-15-21(18-5-3-7-20(13-18)23(24,25)26)27-22(29)19-6-2-4-17(12-19)14-28-8-10-31-11-9-28/h2-7,12-13,15H,8-11,14H2,1H3
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Article
PubMed
n/an/an/an/a 9n/an/an/an/a



Merck Research Laboratory

Curated by ChEMBL


Assay Description
Agonist activity at human cloned CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation


Bioorg Med Chem Lett 21: 182-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.044
BindingDB Entry DOI: 10.7270/Q20P108G
More data for this
Ligand-Target Pair