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Target
Holo-[acyl-carrier-protein] synthase
Ligand
BDBM50178649
Substrate
n/a
Meas. Tech.
ChEMBL_326222 (CHEMBL867576)
IC50
1400±n/a nM
Citation
 Joseph-McCarthy, D; Parris, K; Huang, A; Failli, A; Quagliato, D; Dushin, EG; Novikova, E; Severina, E; Tuckman, M; Petersen, PJ; Dean, C; Fritz, CC; Meshulam, T; DeCenzo, M; Dick, L; McFadyen, IJ; Somers, WS; Lovering, F; Gilbert, AM Use of structure-based drug design approaches to obtain novel anthranilic acid acyl carrier protein synthase inhibitors. J Med Chem 48:7960-9 (2005) [PubMed]  Article 
Target
Name:
Holo-[acyl-carrier-protein] synthase
Synonyms:
ACPS_BACSU | Holo-[acyl-carrieir-protein] synthase | acpS | ydcB
Type:
PROTEIN
Mol. Mass.:
13724.66
Organism:
Bacillus subtilis
Description:
ChEMBL_326222
Residue:
121
Sequence:
MIYGIGLDITELKRIASMAGRQKRFAERILTRSELDQYYELSEKRKNEFLAGRFAAKEAFSKAFGTGIGRQLSFQDIEIRKDQNGKPYIICTKLSQAAVHVSITHTKEYAAAQVVIERLSS
  
Inhibitor
Name:
BDBM50178649
Synonyms:
5-chloro-2-[3-(4-chlorophenyl)-2-methylsulfanyl-propionylamino]benzoic acid | CHEMBL383810 | US11225469, Compound 19
Type:
Small organic molecule
Emp. Form.:
C17H15Cl2NO3S
Mol. Mass.:
384.277
SMILES:
CSC(Cc1ccc(Cl)cc1)C(=O)Nc1ccc(Cl)cc1C(O)=O
Structure:
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