| Reaction Details |
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 | Report a problem with these data |
| Target | Trypanothione reductase |
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| Ligand | BDBM50087156 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEBML_211810 |
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| IC50 | 600±n/a nM |
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| Citation |  Salmon-Chemin, L; Lemaire, A; De Freitas, S; Deprez, B; Sergheraert, C; Davioud-Charvet, E Parallel synthesis of a library of 1,4-naphthoquinones and automated screening of potential inhibitors of trypanothione reductase from Trypanosoma cruzi. Bioorg Med Chem Lett10:631-5 (2000) [PubMed] |
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| More Info.: | Get all data from this article, Assay Method |
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| Trypanothione reductase |
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| Name: | Trypanothione reductase |
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| Synonyms: | N(1),N(8)-bis(glutathionyl)spermidine reductase | TPR | TR | TYTR_TRYCR |
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| Type: | Homodimer; oxidoreductase |
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| Mol. Mass.: | 53868.26 |
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| Organism: | Trypanosoma cruzi |
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| Description: | n/a |
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| Residue: | 492 |
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| Sequence: | MMSKIFDLVVIGAGSGGLEAAWNAATLYKKRVAVIDVQMVHGPPFFSALGGTCVNVGCVP
KKLMVTGAQYMEHLRESAGFGWEFDRTTLRAEWKKLIAVKDEAVLNINKSYEEMFRDTEG
LEFFLGWGSLESKNVVNVRESADPASAVKERLETENILLASGSWPHMPNIPGIEHCISSN
EAFYLPEPPRRVLTVGGGFISVEFAGIFNAYKPKDGQVTLCYRGEMILRGFDHTLREELT
KQLTANGIQILTKENPAKVELNADGSKSVTFESGKKMDFDLVMMAIGRSPRTKDLQLQNA
GVMIKNGGVQVDEYSRTNVSNIYAIGDVTNRVMLTPVAINEAAALVDTVFGTNPRKTDHT
RVASAVFSIPPIGTCGLIEEVASKRYEVVAVYLSSFTPLMHNISGSKYKTFVAKIITNHS
DGTVLGVHLLGDNAPEIIQGVGICLKLNAKISDFYNTIGVHPTSAEELCSMRTPSYYYVK
GEKMEKPSEASL
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| BDBM50087156 |
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| n/a |
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| Name | BDBM50087156 |
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| Synonyms: | 5-{3-[4-(3-Dibutylamino-propylcarbamoyl)-butyl]-8-hydroxy-1,4-dioxo-1,4-dihydro-naphthalen-2-yl}-pentanoic acid (3-dibutylamino-propyl)-amide | CHEMBL159006 |
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| Type | Small organic molecule |
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| Emp. Form. | C42H70N4O5 |
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| Mol. Mass. | 711.029 |
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| SMILES | CCCCN(CCCC)CCCNC(=O)CCCCc1c(O)c2cccc(O)c2c(O)c1C=CCCC(=O)NCCCN(CCCC)CCCC |w:33.35| |
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| Structure | 
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