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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50341942'   
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 1


(Homo sapiens (Human))
BDBM50341942
PNG
(CHEMBL1765267 | cis-rac-((4S,4aR,8aS)-4-hydroxy-4-...)
Show SMILES Cc1cccc(n1)C(=O)N1CC[C@](O)([C@@H]2CCCC[C@H]12)c1ccccc1 |r|
Show InChI InChI=1S/C22H26N2O2/c1-16-8-7-12-19(23-16)21(25)24-15-14-22(26,17-9-3-2-4-10-17)18-11-5-6-13-20(18)24/h2-4,7-10,12,18,20,26H,5-6,11,13-15H2,1H3/t18-,20+,22-/m1/s1
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Similars

Article
PubMed
n/an/a>1.70E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor expressed in CHOK1 cells assessed as inhibition of forskolin-induced cAMP production treated 15 mins before fo...


Bioorg Med Chem Lett 21: 2359-64 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.078
BindingDB Entry DOI: 10.7270/Q2M90901
More data for this
Ligand-Target Pair