Reaction Details Report a problem with these data
Target
Putative glyoxylate/hydroxypyruvate reductase B
Ligand
BDBM392784
Substrate
n/a
Meas. Tech.
in vitro DltA activity assay
IC50
51.0±n/a nM
Citation
 Atamanyuk, D; Chevreuil, F; Faivre, F; Lecointe, N; Ledoussal, B; Oliveira, C; Simon, C; Gerusz, V Heteroaromatic derivatives and their use as pharmaceuticals US Patent  US10301305 Publication Date 5/28/2019 
Target
Name:
Putative glyoxylate/hydroxypyruvate reductase B
Synonyms:
AAD21956.1 | D-alanine--D-alanyl carrier protein ligase | dltA
Type:
Enzyme Catalytic Domain
Mol. Mass.:
35346.87
Organism:
Staphylococcus aureus (strain SA113)
Description:
n/a
Residue:
319
Sequence:
MVKIVVSRKIPDKFYQQLSKLGDVVMWQKSLVPMPKDQFVTALRDADACFITLSEQIDAEILAQSPNLKVIANMAVGYDNIDVESATANNVVVTNTPNVLTETTAELGFTLMLAIARRIVEAEKYVEADAWQSWGPYLLSGKDVFNSTIGIYGMGDIGKAFARRLQGFNTNILYHNRSRHKDAEADFNATYVSFETLLAESDFIICTAPLTKETHHKFNAEAFEQMKNDAIFINIGRGQIVDETALIDALDNKEILACGLDVLANEPIDHTHPLMGRDNVLITPHIGSASVTTRDNMIQLCINNIEAVMTNQVPHTPVN
  
Inhibitor
Name:
BDBM392784
Synonyms:
7-(3,4-Dihydro-2H-pyrano[2,3-b]pyridin-6-yl)-5-[methyl-(2-pyrrolidin-1-yl-ethyl)-amino]-3H-benzimidazole-4-carboxamide | US10301305, Example 181
Type:
Small organic molecule
Emp. Form.:
C23H28N6O2
Mol. Mass.:
420.5074
SMILES:
CN(CCN1CCCC1)c1cc(-c2cnc3OCCCc3c2)c2nc[nH]c2c1C(N)=O
Structure:
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