Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'UDP-3-O-acyl-N-acetylglucosamine deacetylase' and Ligand = 'BDBM23438'   

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
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Aquifex aeolicus)	BDBM23438 (4-[(1E)-oct-1-en-1-yl]benzoate | benzoic acid deri...) Show SMILES CCCCCC\C=C\c1ccc(cc1)C([O-])=O Show InChI InChI=1S/C15H20O2/c1-2-3-4-5-6-7-8-13-9-11-14(12-10-13)15(16)17/h7-12H,2-6H2,1H3,(H,16,17)/p-1/b8-7+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	6.20E+3	n/a	n/a	n/a	7.0	30
University of San Francisco					Assay Description Ligand binding to A. aeolicus LpxC was assayed by isothermal titration using isothermal microcalorimeter from Microcal, Inc. (Northampton, MA). The e...				Bioorg Med Chem 15: 2617-23 (2007) Article DOI: 10.1016/j.bmc.2007.01.044 BindingDB Entry DOI: 10.7270/Q2TT4P8Q
					More data for this Ligand-Target Pair