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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 = 'BDBM50415113'   
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))
BDBM50415113
PNG
(CHEMBL571333)
Show SMILES OC(=O)c1cc(cnc1N1CCCCCC1)-c1cccc(Cl)c1Cl
Show InChI InChI=1S/C18H18Cl2N2O2/c19-15-7-5-6-13(16(15)20)12-10-14(18(23)24)17(21-11-12)22-8-3-1-2-4-9-22/h5-7,10-11H,1-4,8-9H2,(H,23,24)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor expressed in yeast cells


Bioorg Med Chem Lett 19: 6578-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.041
BindingDB Entry DOI: 10.7270/Q2NS0W40
More data for this
Ligand-Target Pair