MUT056399 [Ligand Id: 11000] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL2178284
  • Enoyl-[acyl-carrier-protein] reductase in Escherichia coli [ChEMBL: CHEMBL1857] [UniProtKB: P0AEK4]
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  • Enoyl-[acyl-carrier-protein] reductase (FabI) in S.aureus [ChEMBL: CHEMBL3994] [UniProtKB: Q6GI75]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
Enoyl-[acyl-carrier-protein] reductase in Escherichia coli (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1857] [UniProtKB: P0AEK4]
ChEMBL Inhibition of Escherichia coli FabI in the presence of NADH using crotonyl CoA as substrate by measuring NADH consumption rate B 7.24 pIC50 58 nM IC50 Eur J Med Chem (2020) 208: 112757-112757 [PMID:32883635]
ChEMBL Inhibition of Escherichia coli DH5alpha FabI in the presence of NADH using crotonyl CoA as substrate by measuring NADH consumption rate B 7.24 pIC50 58 nM IC50 Eur J Med Chem (2020) 208: 112757-112757 [PMID:32883635]
Enoyl-[acyl-carrier-protein] reductase (FabI) in S.aureus (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3994] [UniProtKB: Q6GI75]
ChEMBL Inhibition of Staphylococcus aureus recombinant FabI using trans-2-octenoyl N-acetylcysteamine thioester as substrate preincubated for 60 mins B 7.92 pIC50 12 nM IC50 J Med Chem (2012) 55: 9914-9928 [PMID:23092194]
ChEMBL Inhibition of Staphylococcus aureus FabI in the presence of NADH using crotonyl CoA as substrate by measuring NADH consumption rate B 7.92 pIC50 12 nM IC50 Eur J Med Chem (2020) 208: 112757-112757 [PMID:32883635]
ChEMBL Inhibition of Staphylococcus aureus ATCC 29213 FabI in the presence of NADH using crotonyl CoA as substrate by measuring NADH consumption rate B 7.92 pIC50 12 nM IC50 Eur J Med Chem (2020) 208: 112757-112757 [PMID:32883635]

ChEMBL data shown on this page come from version 34:

Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]