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TargetGlutathione reductase, mitochondrial
LigandBDBM50170723
Substrate/Competitorn/a
Meas. Tech.ChEMBL_302540 (CHEMBL827391)
Ki 192000±n/a nM
Citation Meiering, SInhoff, OMies, JVincek, AGarcia, GKramer, BDormeyer, MKrauth-Siegel, RL Inhibitors of Trypanosoma cruzi trypanothione reductase revealed by virtual screening and parallel synthesis. J Med Chem48:4793-802 (2005) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Glutathione reductase, mitochondrial
Name:Glutathione reductase, mitochondrial
Synonyms:GLUR | GRD1 | GSHR_HUMAN | GSR | Glutathione reductase | Glutathione reductase (GR)
Type:Enzyme
Mol. Mass.:56271.52
Organism:Homo sapiens (Human)
Description:P00390
Residue:522
Sequence:
MALLPRALSAGAGPSWRRAARAFRGFLLLLPEPAALTRALSRAMACRQEPQPQGPPPAAG
AVASYDYLVIGGGSGGLASARRAAELGARAAVVESHKLGGTCVNVGCVPKKVMWNTAVHS
EFMHDHADYGFPSCEGKFNWRVIKEKRDAYVSRLNAIYQNNLTKSHIEIIRGHAAFTSDP
KPTIEVSGKKYTAPHILIATGGMPSTPHESQIPGASLGITSDGFFQLEELPGRSVIVGAG
YIAVEMAGILSALGSKTSLMIRHDKVLRSFDSMISTNCTEELENAGVEVLKFSQVKEVKK
TLSGLEVSMVTAVPGRLPVMTMIPDVDCLLWAIGRVPNTKDLSLNKLGIQTDDKGHIIVD
EFQNTNVKGIYAVGDVCGKALLTPVAIAAGRKLAHRLFEYKEDSKLDYNNIPTVVFSHPP
IGTVGLTEDEAIHKYGIENVKTYSTSFTPMYHAVTKRKTKCVMKMVCANKEEKVVGIHMQ
GLGCDEMLQGFAVAVKMGATKADFDNTVAIHPTSSEELVTLR
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50170723
n/a
NameBDBM50170723
Synonyms:1,1'-Hexamethylene bis(5-(p-chlorophenyl)biguanide) | CHEMBL790 | CHLORHEXIDINE | N',N'''''-hexane-1,6-diylbis[N-(4-chlorophenyl)(imidodicarbonimidic diamide)] | N,N'-Bis(4-chlorophenyl)-3,12-diimino-2,4,11,13-tetraazatetradecanediimidamide
TypeSmall organic molecule
Emp. Form.C22H30Cl2N10
Mol. Mass.505.447
SMILESNC(NC(N)=Nc1ccc(Cl)cc1)=NCCCCCCN=C(N)N=C(N)Nc1ccc(Cl)cc1 |w:13.14,20.20,23.23,5.5|
Structure
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