Reaction Details Report a problem with these data
Target
HTH-type transcriptional regulator ExsA
Ligand
BDBM50319083
Substrate
n/a
Meas. Tech.
ChEMBL_635526 (CHEMBL1118109)
IC50
>100000±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:
BDBM50319083
Synonyms:
(E)-3-(6-(dimethylamino)pyridin-3-yl)-N-(4-(1-hydroxy-6-nitro-1H-benzo[d]imidazol-2-yl)phenyl)acrylamide | CHEMBL1085623
Type:
Small organic molecule
Emp. Form.:
C23H20N6O4
Mol. Mass.:
444.4427
SMILES:
CN(C)c1ccc(\C=C\C(=O)Nc2ccc(cc2)-c2nc3ccc(cc3n2O)[N+]([O-])=O)cn1