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Target
Enoyl-[acyl-carrier-protein] reductase [NADH]
Ligand
BDBM50297535
Substrate
n/a
Meas. Tech.
ChEMBL_583543 (CHEMBL1059058)
IC50
4680±n/a nM
Citation
 Lu, XY; Chen, YD; Jiang, YJ; You, QD Discovery of potential new InhA direct inhibitors based on pharmacophore and 3D-QSAR analysis followed by in silico screening. Eur J Med Chem 44:3718-30 (2009) [PubMed]  Article 
Target
Name:
Enoyl-[acyl-carrier-protein] reductase [NADH]
Synonyms:
Enoyl-ACP Reductase (InhA) | Enoyl-[acyl-carrier-protein] reductase | Enoyl-[acyl-carrier-protein] reductase [NADH] | INHA_MYCTU | NADH-dependent enoyl-ACP reductase | inhA
Type:
Enzyme
Mol. Mass.:
28526.00
Organism:
Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
Description:
P9WGR1
Residue:
269
Sequence:
MTGLLDGKRILVSGIITDSSIAFHIARVAQEQGAQLVLTGFDRLRLIQRITDRLPAKAPLLELDVQNEEHLASLAGRVTEAIGAGNKLDGVVHSIGFMPQTGMGINPFFDAPYADVSKGIHISAYSYASMAKALLPIMNPGGSIVGMDFDPSRAMPAYNWMTVAKSALESVNRFVAREAGKYGVRSNLVAAGPIRTLAMSAIVGGALGEEAGAQIQLLEEGWDQRAPIGWNMKDATPVAKTVCALLSDWLPATTGDIIYADGGAHTQLL
  
Inhibitor
Name:
BDBM50297535
Synonyms:
4-chloro-N-(2,4-dichlorobenzylidene)-3-nitroaniline | CHEMBL553790
Type:
Small organic molecule
Emp. Form.:
C13H7Cl3N2O2
Mol. Mass.:
329.566
SMILES:
[O-][N+](=O)c1cc(ccc1Cl)\N=C\c1ccc(Cl)cc1Cl
Structure:
Search PDB for entries with ligand similarity: