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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 = 'BDBM50161577'   
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))
BDBM50161577
PNG
(CHEMBL180949 | xvx4,5-Bis-(4-chloro-phenyl)-1-meth...)
Show SMILES Cn1c(nc(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1)C(=O)N1CCCCC1
Show InChI InChI=1S/C22H21Cl2N3O/c1-26-20(16-7-11-18(24)12-8-16)19(15-5-9-17(23)10-6-15)25-21(26)22(28)27-13-3-2-4-14-27/h5-12H,2-4,13-14H2,1H3
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Similars

Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against human recombinant cannabinoid receptor type 1 expressed in Chinese Hamster Ovary (CHO) cells


Bioorg Med Chem Lett 15: 1441-6 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.078
BindingDB Entry DOI: 10.7270/Q2F18Z7R
More data for this
Ligand-Target Pair