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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 = 'BDBM239146'   
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))
BDBM239146
PNG
((E)-Ethyl 2-(6-(3,4-dimethoxyphenyl)-4-oxohex-5-en...)
Show SMILES CCOC(=O)CNC(=O)CCC(=O)\C=C\c1ccc(OC)c(OC)c1
Show InChI InChI=1S/C18H23NO6/c1-4-25-18(22)12-19-17(21)10-8-14(20)7-5-13-6-9-15(23-2)16(11-13)24-3/h5-7,9,11H,4,8,10,12H2,1-3H3,(H,19,21)/b7-5+
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/a>1.00E+4n/an/an/an/an/an/a



Cairo University



Assay Description
Membranes from HEK-293 cells transfected with the human recombinant CB1 receptor(Bmax=2.5pmol/mg protein) and human recombinant CB2 receptor (B max=4...


J Enzyme Inhib Med Chem 28: 436-9 (2013)


Article DOI: 10.3109/14756366.2011.645241
BindingDB Entry DOI: 10.7270/Q24M93FJ
More data for this
Ligand-Target Pair