Target
Glutathione reductase, mitochondrial
Ligand
BDBM50185400
Substrate
n/a
Meas. Tech.
ChEMBL_360715 (CHEMBL869332)
IC50
>100000±n/a nM
Citation
 Bi, XLopez, CBacchi, CJRattendi, DWoster, PM Novel alkylpolyaminoguanidines and alkylpolyaminobiguanides with potent antitrypanosomal activity. Bioorg Med Chem Lett 16:3229-32 (2006) [PubMed]  Article 
Target
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:
MALLPRALSAGAGPSWRRAARAFRGFLLLLPEPAALTRALSRAMACRQEPQPQGPPPAAGAVASYDYLVIGGGSGGLASARRAAELGARAAVVESHKLGGTCVNVGCVPKKVMWNTAVHSEFMHDHADYGFPSCEGKFNWRVIKEKRDAYVSRLNAIYQNNLTKSHIEIIRGHAAFTSDPKPTIEVSGKKYTAPHILIATGGMPSTPHESQIPGASLGITSDGFFQLEELPGRSVIVGAGYIAVEMAGILSALGSKTSLMIRHDKVLRSFDSMISTNCTEELENAGVEVLKFSQVKEVKKTLSGLEVSMVTAVPGRLPVMTMIPDVDCLLWAIGRVPNTKDLSLNKLGIQTDDKGHIIVDEFQNTNVKGIYAVGDVCGKALLTPVAIAAGRKLAHRLFEYKEDSKLDYNNIPTVVFSHPPIGTVGLTEDEAIHKYGIENVKTYSTSFTPMYHAVTKRKTKCVMKMVCANKEEKVVGIHMQGLGCDEMLQGFAVAVKMGATKADFDNTVAIHPTSSEELVTLR
  
Inhibitor
Name:
BDBM50185400
Synonyms:
CHEMBL378136 | N-(3,3-diphenylpropyl)-1-3-[3-({4-[(3-{N-[3-(3,3-diphenylpropyl)carbamimidamidomethanimidoyl]amino}propyl)amino]butyl}amino)propyl]carbamimidamidomethanimidamide
Type:
Small organic molecule
Emp. Form.:
C44H62N12
Mol. Mass.:
759.0435
SMILES:
NC(NC(=N)NCCC(c1ccccc1)c1ccccc1)=NCCCNCCCCNCCCN=C(N)NC(=N)NCCC(c1ccccc1)c1ccccc1 |w:21.23,34.35|
Structure:
Search PDB for entries with ligand similarity: