BDBM50123100 6,7-Dihydroxy-2-[1-(4-nitro-phenyl)-meth-(E)-ylidene]-benzofuran-3-one::CHEMBL422985

SMILES: Oc1ccc2c([O-])c([CH+]c3ccc(cc3)[N+]([O-])=O)oc2c1O

InChI Key: InChIKey=ZMALCLFUUZNXKI-UHFFFAOYSA-N

Data: 1 IC50

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 1 hit for monomerid = 50123100   

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
Chorismate synthase (Streptococcus pneumoniae)	BDBM50123100 (6,7-Dihydroxy-2-[1-(4-nitro-phenyl)-meth-(E)-ylide...) Show SMILES Oc1ccc2c([O-])c([CH+]c3ccc(cc3)[N+]([O-])=O)oc2c1O Show InChI InChI=1S/C15H9NO6/c17-11-6-5-10-13(18)12(22-15(10)14(11)19)7-8-1-3-9(4-2-8)16(20)21/h1-7H,(H2-,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
PanTherix Ltd. Curated by ChEMBL					Assay Description Inhibitory concentration against Streptococcus pneumoniae chorismate synthase				Bioorg Med Chem Lett 13: 423-6 (2003) BindingDB Entry DOI: 10.7270/Q2TH8M2M
					More data for this Ligand-Target Pair