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Target
HTH-type transcriptional regulator EthR
Ligand
BDBM50395186
Substrate
n/a
Meas. Tech.
ChEMBL_859798 (CHEMBL2169626)
IC50
2900±n/a nM
Citation
 Flipo, M; Willand, N; Lecat-Guillet, N; Hounsou, C; Desroses, M; Leroux, F; Lens, Z; Villeret, V; Wohlkönig, A; Wintjens, R; Christophe, T; Kyoung Jeon, H; Locht, C; Brodin, P; Baulard, AR; Déprez, B Discovery of novel N-phenylphenoxyacetamide derivatives as EthR inhibitors and ethionamide boosters by combining high-throughput screening and synthesis. J Med Chem 55:6391-402 (2012) [PubMed]  Article 
Target
Name:
HTH-type transcriptional regulator EthR
Synonyms:
ETHR_MYCS2 | MSMEI_6273 | ethR
Type:
PROTEIN
Mol. Mass.:
23512.52
Organism:
Mycobacterium smegmatis (strain ATCC 700084 / mc(2)155)
Description:
ChEMBL_859798
Residue:
217
Sequence:
MTTASQTRTPRGRRSARPSGDDREAAILATAQRLLETKKFAEISVDDLAKGAGISRPTFYFYFPSKEAVLLSLIDPLIKRADSGFDNAVESMPADPQRAIRRGIEIFFNSFGSHPATARAGTEALKSSPEFKEFWSGLMQKWIAATAALITAERERGAAPDTIPALDLATSLNLMNERTMMAALADEQPGVAPEKVVATLTHIWLNSIYGTLPVGTA
  
Inhibitor
Name:
BDBM50395186
Synonyms:
CHEMBL1612418
Type:
Small organic molecule
Emp. Form.:
C22H20N4O2
Mol. Mass.:
372.4198
SMILES:
Cc1ccc(cc1)-n1nc2ccc(NC(=O)COc3ccccc3C)cc2n1
Structure:
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