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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 = 'BDBM50323001'   
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))
BDBM50323001
PNG
(3-(5-(4'-carbamoyl-1,4'-bipiperidine-1'-carbonyl)-...)
Show SMILES NC(=O)C1(CCN(CC1)C(=O)c1cc(c(-c2ccc(Cl)cc2)n1CCC(O)=O)-c1ccc(Cl)cc1Cl)N1CCCCC1
Show InChI InChI=1S/C31H33Cl3N4O4/c32-21-6-4-20(5-7-21)28-24(23-9-8-22(33)18-25(23)34)19-26(38(28)15-10-27(39)40)29(41)36-16-11-31(12-17-36,30(35)42)37-13-2-1-3-14-37/h4-9,18-19H,1-3,10-17H2,(H2,35,42)(H,39,40)
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Similars

Article
PubMed
n/an/a 180n/an/an/an/an/an/a



Sanofi-aventis R&D

Curated by ChEMBL


Assay Description
Binding affinity to CB1 receptor in rat brain synaptosomal membranes


Bioorg Med Chem Lett 20: 4573-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.017
BindingDB Entry DOI: 10.7270/Q28G8KV6
More data for this
Ligand-Target Pair