Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Lethal factor/Protective antigen' and Ligand = 'BDBM50010645'   

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
Lethal factor/Protective antigen (Bacillus anthracis)	BDBM50010645 (CHEMBL3264431) Show SMILES Cc1cccc(C)c1NC(=O)N(CC#C)\N=C\c1ccc(Br)cc1 Show InChI InChI=1S/C19H18BrN3O/c1-4-12-23(21-13-16-8-10-17(20)11-9-16)19(24)22-18-14(2)6-5-7-15(18)3/h1,5-11,13H,12H2,2-3H3,(H,22,24)/b21-13+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis lethal toxin-induced mouse RAW264.7 cell death preincubated for 1 hr followed by lethal toxin challenge measured aft...				ACS Med Chem Lett 5: 363-7 (2014) Article DOI: 10.1021/ml400486k BindingDB Entry DOI: 10.7270/Q2M61MTV
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