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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 = 'BDBM50265682'   
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))
BDBM50265682
PNG
(CHEMBL524089 | N'-[(3Z)-6-Methoxy-1-pentyl-2-oxo-1...)
Show SMILES CCCCCN1C(=O)C(=NNC(=O)CN2CCOCC2)c2ccc(OC)cc12 |w:9.9|
Show InChI InChI=1S/C20H28N4O4/c1-3-4-5-8-24-17-13-15(27-2)6-7-16(17)19(20(24)26)22-21-18(25)14-23-9-11-28-12-10-23/h6-7,13H,3-5,8-12,14H2,1-2H3,(H,21,25)
PDB

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Patents


Similars

Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



The University of Texas M. D. Anderson Cancer Center

Curated by ChEMBL


Assay Description
Inverse agonist activity at human recombinant CB1 receptor expressed CHO cells membrane by [35S]GTPgamma binding assay


J Med Chem 52: 433-44 (2009)


Article DOI: 10.1021/jm801353p
BindingDB Entry DOI: 10.7270/Q20G3M2X
More data for this
Ligand-Target Pair