BDBM84558 Phosphate analogue, 9

SMILES: CC(=O)NCCCP(O)(O)=O

InChI Key: InChIKey=MFEBGTGDWTZQCJ-UHFFFAOYSA-N

Data: 1 KI

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 84558   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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)	BDBM84558 (Phosphate analogue, 9) Show SMILES CC(=O)NCCCP(O)(O)=O Show InChI InChI=1S/C5H12NO4P/c1-5(7)6-3-2-4-11(8,9)10/h2-4H2,1H3,(H,6,7)(H2,8,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.50E+6	-3.10	n/a	n/a	n/a	n/a	n/a	8.0	37
University of Bristol					Assay Description The assay was monitored spectrophotometrically through the consumption of beta-NADPH. The inhibitor assays contained inhibitor at concentrations of ...				Chembiochem 6: 1866-74 (2005) Article DOI: 10.1002/cbic.200500061 BindingDB Entry DOI: 10.7270/Q26D5RHB
					More data for this Ligand-Target Pair