BDBM50100859 CHEMBL440285::[2-(2,3-Dihydroxy-phenyl)-ethyl]-phosphonic acid

SMILES: Oc1cccc(CCP(O)(O)=O)c1O

InChI Key: InChIKey=JFHURTLPTBNXJR-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50100859   

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
3-dehydroquinate synthase (Escherichia coli (strain K12))	BDBM50100859 (CHEMBL440285 | [2-(2,3-Dihydroxy-phenyl)-ethyl]-ph...) Show SMILES Oc1cccc(CCP(O)(O)=O)c1O Show InChI InChI=1S/C8H11O5P/c9-7-3-1-2-6(8(7)10)4-5-14(11,12)13/h1-3,9-10H,4-5H2,(H2,11,12,13)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Michigan State University Curated by ChEMBL					Assay Description Inhibition constant for binding to Zn2+ form of 3-dehydroquinate synthase (DHQ) purified from E. coli				Bioorg Med Chem Lett 11: 1493-6 (2001) BindingDB Entry DOI: 10.7270/Q2S75FMH
					More data for this Ligand-Target Pair
3-dehydroquinate synthase (Escherichia coli (strain K12))	BDBM50100859 (CHEMBL440285 | [2-(2,3-Dihydroxy-phenyl)-ethyl]-ph...) Show SMILES Oc1cccc(CCP(O)(O)=O)c1O Show InChI InChI=1S/C8H11O5P/c9-7-3-1-2-6(8(7)10)4-5-14(11,12)13/h1-3,9-10H,4-5H2,(H2,11,12,13)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Michigan State University Curated by ChEMBL					Assay Description Inhibition constant for binding to Co2+ form of 3-dehydroquinate synthase (DHQ) purified from E. coli				Bioorg Med Chem Lett 11: 1493-6 (2001) BindingDB Entry DOI: 10.7270/Q2S75FMH
					More data for this Ligand-Target Pair