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 = 'BDBM50074945'   

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)	BDBM50074945 ((R)-2-Phenyl-4,5-dihydro-oxazole-4-carboxylic acid...) Show SMILES CN(OCc1ccccc1)C(=O)[C@H]1COC(=N1)c1ccccc1 |c:16| Show InChI InChI=1S/C18H18N2O3/c1-20(23-12-14-8-4-2-5-9-14)18(21)16-13-22-17(19-16)15-10-6-3-7-11-15/h2-11,16H,12-13H2,1H3/t16-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of UDP-3-O-[R-3-hydroxymyristoyl]-GlcNAc deacetylase using coupled radiochemical assay (WAVE) in E. coli strain JB 1104				Bioorg Med Chem Lett 9: 313-8 (1999) BindingDB Entry DOI: 10.7270/Q2CJ8CNN
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