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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 = 'BDBM50413759'   
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))
BDBM50413759
PNG
(CHEMBL467263)
Show SMILES CC(C)NC(=O)N1CCN(CC1)C(c1ccc(Cl)cc1)c1ccccc1C(F)(F)F
Show InChI InChI=1S/C22H25ClF3N3O/c1-15(2)27-21(30)29-13-11-28(12-14-29)20(16-7-9-17(23)10-8-16)18-5-3-4-6-19(18)22(24,25)26/h3-10,15,20H,11-14H2,1-2H3,(H,27,30)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 6.61E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant cannabinoid-1 receptor


Bioorg Med Chem Lett 19: 2990-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.037
BindingDB Entry DOI: 10.7270/Q2CN7543
More data for this
Ligand-Target Pair