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SMILES: CCOc1cnn(-c2ccc(cc2)[N+]([O-])=O)c(=O)c1Cl

InChI Key: InChIKey=NUBHDCGUYCARNG-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 33349   

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
Sortase A (Bacillus anthracis)	BDBM33349 (pyridazinone, 2-36) Show SMILES CCOc1cnn(-c2ccc(cc2)[N+]([O-])=O)c(=O)c1Cl Show InChI InChI=1S/C12H10ClN3O4/c1-2-20-10-7-14-15(12(17)11(10)13)8-3-5-9(6-4-8)16(18)19/h3-7H,2H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.47E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of California at Los Angeles					Assay Description A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...				Bioorg Med Chem 17: 7174-85 (2009) Article DOI: 10.1016/j.bmc.2009.08.067 BindingDB Entry DOI: 10.7270/Q26W98F0
					More data for this Ligand-Target Pair
Sortase family protein (Staphylococcus aureus)	BDBM33349 (pyridazinone, 2-36) Show SMILES CCOc1cnn(-c2ccc(cc2)[N+]([O-])=O)c(=O)c1Cl Show InChI InChI=1S/C12H10ClN3O4/c1-2-20-10-7-14-15(12(17)11(10)13)8-3-5-9(6-4-8)16(18)19/h3-7H,2H2,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.19E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of California at Los Angeles					Assay Description A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...				Bioorg Med Chem 17: 7174-85 (2009) Article DOI: 10.1016/j.bmc.2009.08.067 BindingDB Entry DOI: 10.7270/Q26W98F0
					More data for this Ligand-Target Pair