Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'HTH-type transcriptional regulator ExsA' and Ligand = 'BDBM50319079'   

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
HTH-type transcriptional regulator ExsA (Pseudomonas aeruginosa)	BDBM50319079 ((E)-N-(4-(1-hydroxy-6-nitro-1H-benzo[d]imidazol-2-...) Show SMILES CSc1ccc(\C=C\C(=O)Nc2ccc(cc2)-c2nc3ccc(cc3n2O)[N+]([O-])=O)cn1 Show InChI InChI=1S/C22H17N5O4S/c1-32-21-11-3-14(13-23-21)2-10-20(28)24-16-6-4-15(5-7-16)22-25-18-9-8-17(27(30)31)12-19(18)26(22)29/h2-13,29H,1H3,(H,24,28)/b10-2+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.90E+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 PAO1 ExsA DNA binding activity				Bioorg Med Chem Lett 20: 3380-3 (2010) Article DOI: 10.1016/j.bmcl.2010.04.014 BindingDB Entry DOI: 10.7270/Q20R9PJ2
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