BDBM50378358 CHEMBL572948

SMILES: COc1ccc(\C=C\C(=O)Nc2ccc(cc2)-c2nc3ccc(cc3n2O)[N+]([O-])=O)cc1

InChI Key: InChIKey=OJCQHQZIUGPFKL-YIXHJXPBSA-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 = 50378358   

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
Exoenzyme S synthesis regulatory protein exsA (Pseudomonas aeruginosa)	BDBM50378358 (CHEMBL572948) Show SMILES COc1ccc(\C=C\C(=O)Nc2ccc(cc2)-c2nc3ccc(cc3n2O)[N+]([O-])=O)cc1 Show InChI InChI=1S/C23H18N4O5/c1-32-19-10-2-15(3-11-19)4-13-22(28)24-17-7-5-16(6-8-17)23-25-20-12-9-18(27(30)31)14-21(20)26(23)29/h2-14,29H,1H3,(H,24,28)/b13-4+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Paratek Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa ExsA binding to DNA				J Med Chem 52: 5626-34 (2009) Article DOI: 10.1021/jm9006577 BindingDB Entry DOI: 10.7270/Q2XD12KZ
					More data for this Ligand-Target Pair