Reaction Details
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Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI [9-251]
Ligand
BDBM50052238
Substrate
n/a
Meas. Tech.
ChEMBL_1455655 (CHEMBL3365684)
IC50
843±n/a nM
Citation
Takhi, M; Sreenivas, K; Reddy, CK; Munikumar, M; Praveena, K; Sudheer, P; Rao, BN; Ramakanth, G; Sivaranjani, J; Mulik, S; Reddy, YR; Narasimha Rao, K; Pallavi, R; Lakshminarasimhan, A; Panigrahi, SK; Antony, T; Abdullah, I; Lee, YK; Ramachandra, M; Yusof, R; Rahman, NA; Subramanya, H Discovery of azetidine based ene-amides as potent bacterial enoyl ACP reductase (FabI) inhibitors. Eur J Med Chem 84:382-94 (2014) [PubMed] Article More Info.:
Target
Name:
Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI [9-251]
Synonyms:
Enoyl-ACP reductase | FABI_STAAR | fabI
Type:
PROTEIN
Mol. Mass.:
26446.66
Organism:
Staphylococcus aureus
Description:
ChEMBL_1455655
Residue:
243
Sequence:
YVIMGIANKRSIAFGVAKVLDQLGAKLVFTYRKERSRKELEKLLEQLNQPEAHLYQIDVQSDEEVINGFEQIGKDVGNIDGVYHSIAFANMEDLRGRFSETSREGFLLAQDISSYSLTIVAHEAKKLMPEGGSIVATTYLGGEFAVQNYNVMGVAKASLEANVKYLALDLGPDNIRVNAISAGPIRTLSAKGVGGFNTILKEIEERAPLKRNVDQVEVGKTAAYLLSDLSSGVTGENIHVDSG
Inhibitor
Name:
BDBM50052238
Synonyms:
CHEMBL3322725
Type:
Small organic molecule
Emp. Form.:
C24H22N6O3
Mol. Mass.:
442.4699
SMILES:
Cc1c(oc2ccccc12)C1CN(C1)C(=O)\C=C\c1ccc(NC(=O)Cn2ccnn2)nc1
Structure:
