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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 = 'BDBM50310004'   
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


(Rattus norvegicus (rat))
BDBM50310004
PNG
(4-((1H-1,2,4-Triazol-1-yl)methyl)-5-(4-bromophenyl...)
Show SMILES Clc1ccccc1-n1nc(C(=O)NCc2ccccn2)c(Cn2cncn2)c1-c1ccc(Br)cc1
Show InChI InChI=1S/C25H19BrClN7O/c26-18-10-8-17(9-11-18)24-20(14-33-16-28-15-31-33)23(25(35)30-13-19-5-3-4-12-29-19)32-34(24)22-7-2-1-6-21(22)27/h1-12,15-16H,13-14H2,(H,30,35)
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 63.4n/an/an/an/an/an/a



Green Cross Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from CB1 receptor in Sprague-Dawley rat cerebellar membrane


Bioorg Med Chem 18: 1149-62 (2010)


Article DOI: 10.1016/j.bmc.2009.12.040
BindingDB Entry DOI: 10.7270/Q2TD9XG2
More data for this
Ligand-Target Pair