Reaction Details Report a problem with these data
Target
Enoyl-[acyl-carrier-protein] reductase [NADH]
Ligand
BDBM50087289
Substrate
n/a
Meas. Tech.
ChEMBL_966862 (CHEMBL2401006)
IC50
59000±n/a nM
Citation
Hu, X; Compton, JR; Abdulhameed, MD; Marchand, CL; Robertson, KL; Leary, DH; Jadhav, A; Hershfield, JR; Wallqvist, A; Friedlander, AM; Legler, PM 3-substituted indole inhibitors against Francisella tularensis FabI identified by structure-based virtual screening. J Med Chem 56:5275-87 (2014) [PubMed] Article
More Info.:
Target
Name:
Enoyl-[acyl-carrier-protein] reductase [NADH]
Synonyms:
fabI
Type:
PROTEIN
Mol. Mass.:
27804.42
Organism:
Francisella tularensis subsp. tularensis (strain SCHU S4 / Schu 4)
Description:
Q5NGQ3
Residue:
260
Sequence:
MGFLAGKKILITGLLSNKSIAYGIAKAMHREGAELAFTYVGQFKDRVEKLCAEFNPAAVLPCDVISDQEIKDLFVELGKVWDGLDAIVHSIAFAPRDQLEGNFIDCVTREGFSIAHDISAYSFAALAKEGRSMMKNRNASMVALTYIGAEKAMPSYNTMGVAKASLEATVRYTALALGEDGIKVNAVSAGPIKTLAASGISNFKKMLDYNAMVSPLKKNVDIMEVGNTVAFLCSDMATGITGEVVHVDAGYHCVSMGNVL
Inhibitor
Name:
BDBM50087289
Synonyms:
1-beta-D-Arabinofuranosylcytosine | 4-Amino-1-beta-D-arabinofuranosyl-2(1H)-pyrimidinone | 4-amino-1-beta-D-arabinofuranosylpyrimidin-2(1H)-one | CHEMBL803 | CYTARABINE
Type:
Small organic molecule
Emp. Form.:
C9H13N3O5
Mol. Mass.:
243.2166
SMILES:
Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)n1 |r|