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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 = 'BDBM50377665'   
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))
BDBM50377665
PNG
(CHEMBL257777)
Show SMILES CC(C)Cn1nnc(CNC(=O)c2ccc(cc2)-c2ccccc2)n1
Show InChI InChI=1S/C19H21N5O/c1-14(2)13-24-22-18(21-23-24)12-20-19(25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3,(H,20,25)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Binding affinity to human CB1 receptor expressed in COS cells


Bioorg Med Chem Lett 18: 2820-4 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.003
BindingDB Entry DOI: 10.7270/Q22808H1
More data for this
Ligand-Target Pair