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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 = 'BDBM50095868'   
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))
BDBM50095868
PNG
(CHEMBL3588878)
Show SMILES Cc1cccc2C(=O)\C(=C/NC(C)(C)C)C(=O)N(CC3CC3)c12
Show InChI InChI=1S/C19H30N6O4/c1-2-3-4-5-6-7-8-9-21-18(28)15-13(26)14(27)19(29-15)25-11-24-12-16(20)22-10-23-17(12)25/h10-11,13-15,19,26-27H,2-9H2,1H3,(H,21,28)(H2,20,22,23)/t13?,14?,15-,19+/m0/s1
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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Agonist activity at CB1R (unknown origin) CHO cells stably expressing Galpha16 assessed as increase in intracellular calcium level by microplate read...


J Med Chem 58: 5751-69 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00227
BindingDB Entry DOI: 10.7270/Q2Z039X8
More data for this
Ligand-Target Pair