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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetyl-CoA carboxylase 1' and Ligand = 'BDBM50302330'   
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 1


(Homo sapiens (Human))		BDBM50302330
PNG
(CHEMBL586039 | N-(1-(4-(6-(4-propoxyphenoxy)pyridi...)
Show SMILES CCCOc1ccc(Oc2ccc(cn2)-c2ccc(cc2)C(C)NC(=O)C(C)C)cc1
Show InChI InChI=1S/C26H30N2O3/c1-5-16-30-23-11-13-24(14-12-23)31-25-15-10-22(17-27-25)21-8-6-20(7-9-21)19(4)28-26(29)18(2)3/h6-15,17-19H,5,16H2,1-4H3,(H,28,29)
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PC cid
PC sid
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Similars
Article
PubMed
n/an/a 451n/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ACC 1 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