Reaction Details Report a problem with these data
Target
HTH-type transcriptional regulator ExsA
Ligand
BDBM50319086
Substrate
n/a
Meas. Tech.
ChEMBL_635526 (CHEMBL1118109)
IC50
>49000±n/a nM
Citation
Grier, MC; Garrity-Ryan, LK; Bartlett, VJ; Klausner, KA; Donovan, PJ; Dudley, C; Alekshun, MN; Tanaka, SK; Draper, MP; Levy, SB; Kim, OK N-Hydroxybenzimidazole inhibitors of ExsA MAR transcription factor in Pseudomonas aeruginosa: In vitro anti-virulence activity and metabolic stability. Bioorg Med Chem Lett 20:3380-3 (2010) [PubMed] Article
More Info.:
Target
Name:
HTH-type transcriptional regulator ExsA
Synonyms:
EXSA_PSEAE | Exoenzyme S synthesis regulatory protein exsA | exsA
Type:
PROTEIN
Mol. Mass.:
31648.37
Organism:
Pseudomonas aeruginosa
Description:
ChEMBL_635526
Residue:
278
Sequence:
MQGAKSLGRKQITSCHWNIPTFEYRVNKEEGVYVLLEGELTVQDIDSTFCLAPGELLFVRRGSYVVSTKGKDSRILWIPLSAQFLQGFVQRFGALLSEVERCDEPVPGIIAFAATPLLAGCVKGLKELLVHEHPPMLACLKIEELLMLFAFSPQGPLLMSVLRQLSNRHVERLQLFMEKHYLNEWKLSDFSREFGMGLTTFKELFGSVYGVSPRAWISERRILYAHQLLLNSDMSIVDIAMEAGFSSQSYFTQSYRRRFGCTPSRSRQGKDECRAKNN
Inhibitor
Name:
BDBM50319086
Synonyms:
(E)-3-(4-acetylphenyl)-N-(2-amino-2-oxoethyl)-N-(4-(6-cyano-1-hydroxy-1H-benzo[d]imidazol-2-yl)phenyl)acrylamide | CHEMBL1084083
Type:
Small organic molecule
Emp. Form.:
C27H21N5O4
Mol. Mass.:
479.4867
SMILES:
CC(=O)c1ccc(C=CC(=O)N(CC(N)=O)c2ccc(cc2)-c2nc3ccc(cc3n2O)C#N)cc1 |w:8.8|