Reaction Details Report a problem with these data
Target
Mevalonate kinase
Ligand
BDBM38627
Substrate
n/a
Meas. Tech.
Screening for Inhibitors of the Mevalonate Pathway in Streptococcus Pneumoniae - MK Dose Response
IC50
84256.5±n/a nM
Citation
 PubChem, PC Screening for Inhibitors of the Mevalonate Pathway in Streptococcus Pneumoniae - MK Dose Response PubChem Bioassay (2007)[AID] 
Target
Name:
Mevalonate kinase
Synonyms:
n/a
Type:
Enzyme Catalytic Domain
Mol. Mass.:
31420.64
Organism:
Streptococcus pneumoniae D39
Description:
A0A0H2ZQX9
Residue:
292
Sequence:
MTKKVGVGQAHSKIILIGEHAVVYGYPAISLPLLEVEVTCKVVPAESPWRLYEEDTLSMAVYASLEYLNITEACIRCEIDSAIPEKRGMGSSAAISIAAIRAVFDYYQADLPHDVLEILVNRAEMIAHMNPSGLDAKTCLSDQPIRFIKNVGFTELEMDLSAYLVIADTGVYGHTREAIQVVQNKGKDALPFLHALGELTQQAEIAISQKDAEGLGQILSQAHLHLKEIGVSSLEADSLVETALSHGALGAKMSGGGLGGCIIALVTNLTHAQELAERLEEKGAVQTWIESL
  
Inhibitor
Name:
BDBM38627
Synonyms:
(4Z)-4-[1,3-benzodioxol-5-yl(hydroxy)methylene]-1-(2-morpholinoethyl)-5-(4-pyridyl)pyrrolidine-2,3-quinone | (4Z)-4-[1,3-benzodioxol-5-yl(hydroxy)methylidene]-1-(2-morpholin-4-ylethyl)-5-pyridin-4-ylpyrrolidine-2,3-dione | (4Z)-4-[1,3-benzodioxol-5-yl(hydroxy)methylidene]-1-[2-(4-morpholinyl)ethyl]-5-pyridin-4-ylpyrrolidine-2,3-dione | (4Z)-4-[1,3-benzodioxol-5-yl(oxidanyl)methylidene]-1-(2-morpholin-4-ylethyl)-5-pyridin-4-yl-pyrrolidine-2,3-dione | 4-(1,3-benzodioxol-5-ylcarbonyl)-3-hydroxy-1-[2-(4-morpholinyl)ethyl]-5-(4-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one | MLS000049507 | SMR000075541 | cid_5771717
Type:
Small organic molecule
Emp. Form.:
C23H23N3O6
Mol. Mass.:
437.4452
SMILES:
O=C(C1C(N(CCN2CCOCC2)C(=O)C1=O)c1ccncc1)c1ccc2OCOc2c1
Structure:
Search PDB for entries with ligand similarity: