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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 = 'BDBM50277380'   
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))
BDBM50277380
PNG
((1S,2S,4R)-1,4-dimethyl-N-(4-methyl-3-(morpholinos...)
Show SMILES Cc1ccc(NC(=O)[C@H]2C[C@@]3(C)CC[C@]2(C)O3)cc1S(=O)(=O)N1CCOCC1 |r|
Show InChI InChI=1S/C20H28N2O5S/c1-14-4-5-15(12-17(14)28(24,25)22-8-10-26-11-9-22)21-18(23)16-13-19(2)6-7-20(16,3)27-19/h4-5,12,16H,6-11,13H2,1-3H3,(H,21,23)/t16-,19-,20+/m1/s1
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PC cid
PC sid
UniChem
Article
PubMed
2.00E+3n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human cloned CB2 receptor by scintillation spectrometry


Bioorg Med Chem Lett 19: 309-13 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.091
BindingDB Entry DOI: 10.7270/Q2G73DK3
More data for this
Ligand-Target Pair