Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glutamate racemase' and Ligand = 'BDBM50263109'   

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
Glutamate racemase (Enterococcus faecalis)	BDBM50263109 (9-(2,6-difluoro-3-methylbenzyl)-2-butoxy-9H-purin-...) Show SMILES CCCCOc1nc(N)c2ncn(Cc3c(F)ccc(C)c3F)c2n1 Show InChI InChI=1S/C17H19F2N5O/c1-3-4-7-25-17-22-15(20)14-16(23-17)24(9-21-14)8-11-12(18)6-5-10(2)13(11)19/h5-6,9H,3-4,7-8H2,1-2H3,(H2,20,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Boston Curated by ChEMBL					Assay Description Inhibition of Enterococcus faecalis MurI				Bioorg Med Chem Lett 18: 4368-72 (2008) Article DOI: 10.1016/j.bmcl.2008.06.068 BindingDB Entry DOI: 10.7270/Q28052D6
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