Reaction Details Report a problem with these data
Target
3-oxoacyl-[acyl-carrier-protein] synthase 3
Ligand
BDBM50201528
Substrate
n/a
Meas. Tech.
ChEMBL_441462 (CHEMBL891691)
IC50
14400±n/a nM
Citation
 Alhamadsheh, MM; Waters, NC; Huddler, DP; Kreishman-Deitrick, M; Florova, G; Reynolds, KA Synthesis and biological evaluation of thiazolidine-2-one 1,1-dioxide as inhibitors of Escherichia coli beta-ketoacyl-ACP-synthase III (FabH). Bioorg Med Chem Lett 17:879-83 (2007) [PubMed]  Article 
Target
Name:
3-oxoacyl-[acyl-carrier-protein] synthase 3
Synonyms:
3-oxoacyl-[acyl-carrier-protein] synthase | 3-oxoacyl-[acyl-carrier-protein] synthase 3 | 3-oxoacyl-[acyl-carrier-protein] synthase III | Beta-ketoacyl-ACP synthase III (FabH)
Type:
Enzyme
Mol. Mass.:
33506.68
Organism:
Escherichia coli
Description:
C3TDZ2
Residue:
317
Sequence:
MYTKIIGTGSYLPEQVRTNADLEKMVDTSDEWIVTRTGIRERHIAAPNETVSTMGFEAATRAIEMAGIEKDQIGLIVVATTSATHAFPSAACQIQSMLGIKGCPAFDVAAACAGFTYALSVADQYVKSGAVKYALVVGSDVLARTCDPTDRGTIIIFGDGAGAAVLAASEEPGIISTHLHADGSYGELLTLPNADRVNPENSIHLTMAGNEVFKVAVTELAHIVDETLAANNLDRSQLDWLVPHQANLRIISATAKKLGMSMDNVVVTLDRHGNTSAASVPCALDEAVRDGRIKPGQLVLLEAFGGGFTWGSALVRF
  
Inhibitor
Name:
BDBM50201528
Synonyms:
3-(4-(4-cyclopentylphenoxy)benzyl)thiazolidin-2-one | CHEMBL393088
Type:
Small organic molecule
Emp. Form.:
C21H23NO2S
Mol. Mass.:
353.478
SMILES:
O=C1SCCN1Cc1ccc(Oc2ccc(cc2)C2CCCC2)cc1
Structure:
Search PDB for entries with ligand similarity: