Reaction Details Report a problem with these data
Target
Glucokinase 1, putative
Ligand
BDBM514001
Substrate
n/a
Meas. Tech.
enzyme-inhibition screening assay
IC50
16080±160 nM
Citation
 D''Antonio, E Monosaccharide amine and 3-nitro-2-phenyl-2H-chromene based inhibitors of glucose kinases US Patent  US11059842 Publication Date 7/13/2021 
Target
Name:
Glucokinase 1, putative
Synonyms:
Q4E4E1_TRYCC
Type:
Protein
Mol. Mass.:
41591.25
Organism:
Trypanosoma cruzi (strain CL Brener)
Description:
Q4E4E1
Residue:
376
Sequence:
MNIKELSLHELCEELKTPAWNVPLTFVGDVGGTSARMGFVREGKNDSVHACVTRYSMKRKDITELIEFFNEIIELMPASVIKRVKAGVINVPGPVTGGAVGGPFNNLKGIARLSDYPKALFPPGRSAILNDLEAGGFGVLAVSDAHVFSEYFGVMWEGTQWRTCEQEPAGSVIGRGRCLVLAPGTGLGSSLIYYNPMNQQHIVVPLELGSQTIPMRKDIDYIQTLHAELKLLPNYENMVSGAGLEFHYRQVVRGSRPPCSAGEIAKLASEGDANACKAMKKYHEYLMRVGSEASMALLPLTIVLVGDNIVNNAFFYRNPQNLKEMHREALNHEMERFGFQSRVTYLRQKKLLNLNLMGCYRCGLDLSVGKKQKAQL
  
Inhibitor
Name:
BDBM514001
Synonyms:
US11059842, Compound 1
Type:
Small organic molecule
Emp. Form.:
C13H17NO6
Mol. Mass.:
283.2772
SMILES:
OC[C@H]1OC(O)[C@H](NC(=O)c2ccccc2)[C@@H](O)[C@@H]1O |r,w:4.4|
Structure:
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