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 = 'BDBM50118581'   

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 (Escherichia coli)	BDBM50118581 ((R/S)-3-(4-Methoxy-phenyl)-4,5-dihydro-isoxazole-5...) Show SMILES COc1ccc(cc1)C1=NOC(C1)C(=O)Nc1ccccn1 |t:9| Show InChI InChI=1S/C16H15N3O3/c1-21-12-7-5-11(6-8-12)13-10-14(22-19-13)16(20)18-15-4-2-3-9-17-15/h2-9,14H,10H2,1H3,(H,17,18,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>3.36E+5	n/a	n/a	n/a	n/a	n/a	n/a
Duke University Curated by ChEMBL					Assay Description Inhibition of E. coli LpxC(UDP-3-O-[R-3-hydroxymyristoyl]-GlcNAc deacetylase.				J Med Chem 45: 4359-70 (2002) BindingDB Entry DOI: 10.7270/Q2W66K3D
					More data for this Ligand-Target Pair