Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '1-deoxy-D-xylulose 5-phosphate reductoisomerase' and Ligand = 'BDBM50181147'   

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
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli)	BDBM50181147 (3-(N-hydroxyacetamido)-1-phenylpropylphosphonic ac...) Show SMILES CC(=O)N(O)CCC(c1ccccc1)P(O)(O)=O Show InChI InChI=1S/C11H16NO5P/c1-9(13)12(14)8-7-11(18(15,16)17)10-5-3-2-4-6-10/h2-6,11,14H,7-8H2,1H3,(H2,15,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	282	n/a	n/a	n/a	n/a	n/a	n/a
Philipps University Curated by ChEMBL					Assay Description Inhibitory concentration against DOXP reductoisomerase				J Med Chem 48: 3547-63 (2005) Article DOI: 10.1021/jm0491501 BindingDB Entry DOI: 10.7270/Q2VH5Q21
					More data for this Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli)	BDBM50181147 (3-(N-hydroxyacetamido)-1-phenylpropylphosphonic ac...) Show SMILES CC(=O)N(O)CCC(c1ccccc1)P(O)(O)=O Show InChI InChI=1S/C11H16NO5P/c1-9(13)12(14)8-7-11(18(15,16)17)10-5-3-2-4-6-10/h2-6,11,14H,7-8H2,1H3,(H2,15,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	311	n/a	n/a	n/a	n/a	n/a	n/a
Ghent University Curated by ChEMBL					Assay Description Inhibition of recombinant Escherichia coli DXR				Bioorg Med Chem Lett 16: 1888-91 (2006) Article DOI: 10.1016/j.bmcl.2005.12.082 BindingDB Entry DOI: 10.7270/Q2FJ2GB6
					More data for this Ligand-Target Pair