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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetyl-CoA carboxylase 2' and Ligand = 'BDBM50302356'   
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
Acetyl-CoA carboxylase 2


(Homo sapiens (Human))
BDBM50302356
PNG
(CHEMBL566872 | N-(1-(4'-(4-isopropoxyphenoxy)-2-me...)
Show SMILES CC(C)Oc1ccc(Oc2ccc(cc2)-c2ccc(cc2C)C(C)NC(C)=O)cc1
Show InChI InChI=1S/C26H29NO3/c1-17(2)29-23-11-13-25(14-12-23)30-24-9-6-21(7-10-24)26-15-8-22(16-18(26)3)19(4)27-20(5)28/h6-17,19H,1-5H3,(H,27,28)
PDB
MMDB

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Article
PubMed
n/an/a 303n/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ACC 2 expressed in baculovirus expression system by FAS-coupled assay


Bioorg Med Chem Lett 19: 5872-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.077
BindingDB Entry DOI: 10.7270/Q24J0F6F
More data for this
Ligand-Target Pair