Target
Thioredoxin reductase
Ligand
BDBM50385302
Substrate
n/a
Meas. Tech.
Inhibition Assay
Ki
4e+1±n/a nM
IC50
2.1e+3±n/a nM
Citation
 Holmgren, ALu, JVlamis-Gardikas, AZhao, RKandasamy, KEngman, LEngstrand, LHoffner, S Bacterial thioredoxin reductase inhibitors and methods for use thereof US Patent  US8592468 Publication Date 11/26/2013 
Target
Name:
Thioredoxin reductase
Synonyms:
TRXB_ECOLI | Thioredoxin reductase (TrxR) | trxB
Type:
Protein
Mol. Mass.:
34615.59
Organism:
Escherichia coli (strain K12)
Description:
P0A9P4
Residue:
321
Sequence:
MGTTKHSKLLILGSGPAGYTAAVYAARANLQPVLITGMEKGGQLTTTTEVENWPGDPNDLTGPLLMERMHEHATKFETEIIFDHINKVDLQNRPFRLNGDNGEYTCDALIIATGASARYLGLPSEEAFKGRGVSACATCDGFFYRNQKVAVIGGGNTAVEEALYLSNIASEVHLIHRRDGFRAEKILIKRLMDKVENGNIILHTNRTLEEVTGDQMGVTGVRLRDTQNSDNIESLDVAGLFVAIGHSPNTAIFEGQLELENGYIKVQSGIHGNATQTSIPGVFAAGDVMDHIYRQAITSAGTGCMAALDAERYLDGLADAK
  
Inhibitor
Name:
BDBM50385302
Synonyms:
CHEMBL2035461 | US8592468, EbSe15
Type:
Small organic molecule
Emp. Form.:
C17H14N2O2Se2
Mol. Mass.:
436.23
SMILES:
O=c1n(CCCn2[se]c3ccccc3c2=O)[se]c2ccccc12
Structure:
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