Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Poly-beta-1,6-N-acetyl-D-glucosamine N-deacetylase' and Ligand = 'BDBM50466406'   

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
Poly-beta-1,6-N-acetyl-D-glucosamine N-deacetylase (Escherichia coli (Enterobacteria))	BDBM50466406 (CHEMBL4283218) Show SMILES CC(=O)N[C@H]1[C@H](OCc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1N=[N+]=[N-] |r| Show InChI InChI=1S/C15H20N4O5/c1-9(21)17-13-12(18-19-16)14(22)11(7-20)24-15(13)23-8-10-5-3-2-4-6-10/h2-6,11-15,20,22H,7-8H2,1H3,(H,17,21)/t11-,12-,13-,14-,15-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Toronto Curated by ChEMBL					Assay Description Inhibition of Escherichia coli PgaB expressed in Escherichia coli BL21 (DE3) cells transformed with pET28 plasmid coding for PgaB42-655 using acetoxy...				Bioorg Med Chem 26: 5631-5643 (2018) Article DOI: 10.1016/j.bmc.2018.10.008 BindingDB Entry DOI: 10.7270/Q208681D
					More data for this Ligand-Target Pair