Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Listeriolysin regulatory protein' and Ligand = 'BDBM50453144'   

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
Listeriolysin regulatory protein (Listeria monocytogenes serovar 1/2a (strain ATCC B...)	BDBM50453144 (CHEMBL4215787) Show SMILES CN(C)c1c2SCC(C(O)=O)n2c(=O)cc1Cc1cccc(C)c1C Show InChI InChI=1S/C19H22N2O3S/c1-11-6-5-7-13(12(11)2)8-14-9-16(22)21-15(19(23)24)10-25-18(21)17(14)20(3)4/h5-7,9,15H,8,10H2,1-4H3,(H,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity to Listeria monocytogenes 6-His-tagged PrfA expressed in Escherichia coli BL21 (DE3) pLysS assessed as inhibition of protein binding...				J Med Chem 61: 4165-4175 (2018) Article DOI: 10.1021/acs.jmedchem.8b00289 BindingDB Entry DOI: 10.7270/Q2T1566G
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