Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phenylalanine--tRNA ligase alpha/beta subunit' and Ligand = 'BDBM18109'   

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
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18109 (3-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES CNC(=O)CNC(=O)CCOc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C19H24BrN3O4S/c1-21-19(26)11-23-18(25)6-7-27-16-5-3-2-4-13(16)9-22-10-15(24)17-8-14(20)12-28-17/h2-5,8,12,15,22,24H,6-7,9-11H2,1H3,(H,21,26)(H,23,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
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