Reaction Details Report a problem with these data
Target
Putative glyoxylate/hydroxypyruvate reductase B
Ligand
BDBM392742
Substrate
n/a
Meas. Tech.
in vitro DltA activity assay
IC50
11.0±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:
BDBM392742
Synonyms:
US10301305, Example 6 | {1-[7-(1-Cyclohexyl-1H-benzimidazol-5-yl)-3H-imidazo[4,5-b]pyridin-5-yl]-4-hydroxymethyl-piperidin-4-yl}-methanol
Type:
Small organic molecule
Emp. Form.:
C26H32N6O2
Mol. Mass.:
460.5713
SMILES:
OCC1(CO)CCN(CC1)c1cc(-c2ccc3n(cnc3c2)C2CCCCC2)c2nc[nH]c2n1
Structure:
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