Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetyl-CoA carboxylase 1' and Ligand = 'BDBM527546'   

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))	BDBM527546 (US11186587, Example 29) Show SMILES COc1ccccc1C(Cn1c2sc(c(C)c2c(=O)n(-c2cccc(C(O)=O)c2OC)c1=O)-c1ncco1)OC1CCOCC1 |(-2.86,-3.85,;-1.53,-3.08,;-.19,-3.85,;-.19,-5.39,;1.14,-6.16,;2.47,-5.39,;2.47,-3.85,;1.14,-3.08,;1.14,-1.54,;-.19,-.77,;-.19,.77,;-1.53,1.54,;-2.99,1.06,;-3.9,2.31,;-2.99,3.56,;-3.47,5.02,;-1.53,3.08,;-.19,3.85,;-.19,5.39,;1.14,3.08,;2.47,3.85,;2.47,5.39,;3.81,6.16,;5.14,5.39,;5.19,3.82,;6.52,3.05,;6.52,1.51,;7.86,3.82,;3.81,3.08,;3.81,1.54,;5.14,.77,;1.14,1.54,;2.47,.77,;-5.44,2.31,;-6.34,3.56,;-7.81,3.08,;-7.81,1.54,;-6.34,1.06,;2.47,-.77,;3.81,-1.54,;3.81,-3.08,;5.14,-3.85,;6.47,-3.08,;6.47,-1.54,;5.14,-.77,)| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.13	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description 4.5 μL of 2.2×ACC1 enzyme (2 nM) working solution was added to a 384-well plate; and then 0.5 μL of different concentrations of compound we...				Citation and Details BindingDB Entry DOI: 10.7270/Q25H7KFV
					More data for this Ligand-Target Pair