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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glutamate racemase' and Ligand = 'BDBM50256681'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Glutamate racemase


(Helicobacter pylori J99)
BDBM50256681
PNG
(5-(furan-2-yl)-N-methyl-3-(thiazol-5-yl)-3H-pyrido...)
Show SMILES CNC1=Nc2ncccc2C(=NC1c1cncs1)c1ccco1 |c:11,t:2|
Show InChI InChI=1S/C16H13N5OS/c1-17-16-14(12-8-18-9-23-12)20-13(11-5-3-7-22-11)10-4-2-6-19-15(10)21-16/h2-9,14H,1H3,(H,17,19,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 8.60E+3n/an/an/an/an/an/a



AstraZeneca R&D Boston

Curated by ChEMBL


Assay Description
Inhibition of MurI in wild type Helicobacter pylori J99


Bioorg Med Chem Lett 19: 930-6 (2009)


Article DOI: 10.1016/j.bmcl.2008.11.113
BindingDB Entry DOI: 10.7270/Q2J38SDJ
More data for this
Ligand-Target Pair