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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 = 'BDBM50116846'   
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))
BDBM50116846
PNG
((S)-2-[(E)-3-(4-Methoxy-3-pentyloxy-phenyl)-acrylo...)
Show SMILES CCCCCOc1cc(\C=C\C(=O)N[C@@H](Cc2ccccc2)C(=O)OC)ccc1OC
Show InChI InChI=1S/C25H31NO5/c1-4-5-9-16-31-23-18-20(12-14-22(23)29-2)13-15-24(27)26-21(25(28)30-3)17-19-10-7-6-8-11-19/h6-8,10-15,18,21H,4-5,9,16-17H2,1-3H3,(H,26,27)/b15-13+/t21-/m0/s1
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Similars

PubMed
86n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Binding affinity against human Cannabinoid receptor 2 expressed in CHO cells by using WIN 55,2122Mesylate [5,73H] as Radioactive tracer


Bioorg Med Chem Lett 12: 2399-402 (2002)


BindingDB Entry DOI: 10.7270/Q2TM79FG
More data for this
Ligand-Target Pair