Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetyl-CoA carboxylase 1' and Ligand = 'BDBM50302343'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Acetyl-CoA carboxylase 1 (Homo sapiens (Human))	BDBM50302343 (CHEMBL565418 | N-(1-(4'-(4-benzoylphenoxy)biphenyl...) Show SMILES CC(NC(C)=O)c1ccc(cc1)-c1ccc(Oc2ccc(cc2)C(=O)c2ccccc2)cc1 Show InChI InChI=1S/C29H25NO3/c1-20(30-21(2)31)22-8-10-23(11-9-22)24-12-16-27(17-13-24)33-28-18-14-26(15-19-28)29(32)25-6-4-3-5-7-25/h3-20H,1-2H3,(H,30,31)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/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
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