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Literature summary extracted from

  • Walton, J.G.; Jones, D.C.; Kiuru, P.; Durie, A.J.; Westwood, N.J.; Fairlamb, A.H.
    Synthesis and evaluation of indatraline-based inhibitors for trypanothione reductase (2011), ChemMedChem, 6, 321-328.
    View publication on PubMedView publication on EuropePMC

Inhibitors

EC Number Inhibitors Comment Organism Structure
1.8.1.12 (1S,3S)-3-(3,4-dichlorophenyl)-N-methyl-2,3-dihydro-1H-inden-1-amine
-
 Trypanosoma brucei
1.8.1.12 1-[1-(1-benzothiophen-2-yl)cyclohexyl]piperidine
-
 Trypanosoma brucei
1.8.1.12 indatraline
-
 Trypanosoma brucei
1.8.1.12 trans-4-[3-(3,4-dichlorophenyl)indan-1-yl]morpholine
-
 Trypanosoma brucei
1.8.1.12 trans-benzyl-[3-(3,4-dichlorophenyl)-6-methoxyindan-1-yl]amine
-
 Trypanosoma brucei
1.8.1.12 trans-N-[3-(3,4-dichlorophenyl)indan-1-yl]-4-methylbenzenesulfonamide
-
 Trypanosoma brucei
1.8.1.12 trans-N-[3-(3,4-dichlorophenyl)indan-1-yl]acetamide
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(3,4-dibromophenyl)-6-methoxyindan-1-yl]-(3-methylbutyl)amine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(3,4-dichlorophenyl)-6-methoxyindan-1-yl]-(3-methylbutyl)amine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(3,4-dichlorobenzyl)amine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(3-methylbutyl)amine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(4-aminobenzyl)amine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(4-chlorobenzyl)amine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(4-dimethylaminobenzyl)amine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(4-methoxybenzyl)amine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(4-methylbenzyl)amine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(3,4-dichlorophenyl)indan-1-yl]octylamine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(4-chlorophenyl)-6-methoxyindan-1-yl]-(3-methylbutyl)-amine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(4-methoxyphenyl)-6-methoxyindan-1-yl]-(3-methylbutyl)amine
-
 Trypanosoma brucei
1.8.1.12 trans-[3-(4-methylphenyl)-6-methoxyindan-1-yl]-(3-methylbutyl)-amine
-
 Trypanosoma brucei

Organism

EC Number Organism UniProt Comment Textmining
1.8.1.12 Trypanosoma brucei
-
-
-

Substrates and Products (Substrate)

EC Number Substrates Comment Substrates Organism Products Comment (Products) Rev. Reac.
1.8.1.12 trypanothione disulfide + NADPH + H+
-
 Trypanosoma brucei trypanothione + NADP+
-
 ?

Synonyms

EC Number Synonyms Comment Organism
1.8.1.12 trypanothione reductase
-
 Trypanosoma brucei
1.8.1.12 TryR
-
 Trypanosoma brucei

Cofactor

EC Number Cofactor Comment Organism Structure
1.8.1.12 NADPH
-
 Trypanosoma brucei

IC50 Value

EC Number IC50 Value IC50 Value Maximum Comment Organism Inhibitor Structure
1.8.1.12 0.00223
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(3,4-dichlorophenyl)-6-methoxyindan-1-yl]-(3-methylbutyl)amine
1.8.1.12 0.00307
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-benzyl-[3-(3,4-dichlorophenyl)-6-methoxyindan-1-yl]amine
1.8.1.12 0.00315
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(3,4-dibromophenyl)-6-methoxyindan-1-yl]-(3-methylbutyl)amine
1.8.1.12 0.00405
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(3-methylbutyl)amine
1.8.1.12 0.00414
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(4-methoxybenzyl)amine
1.8.1.12 0.00494
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(4-aminobenzyl)amine
1.8.1.12 0.00738
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(4-dimethylaminobenzyl)amine
1.8.1.12 0.00793
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(3,4-dichlorophenyl)indan-1-yl]octylamine
1.8.1.12 0.00884
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei indatraline
1.8.1.12 0.013
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(4-methylbenzyl)amine
1.8.1.12 0.0158
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(4-chlorophenyl)-6-methoxyindan-1-yl]-(3-methylbutyl)-amine
1.8.1.12 0.0176
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(4-chlorobenzyl)amine
1.8.1.12 0.0329
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(4-methylphenyl)-6-methoxyindan-1-yl]-(3-methylbutyl)-amine
1.8.1.12 0.0459
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(3,4-dichlorophenyl)indan-1-yl]-(3,4-dichlorobenzyl)amine
1.8.1.12 0.125
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-[3-(4-methoxyphenyl)-6-methoxyindan-1-yl]-(3-methylbutyl)amine
1.8.1.12 0.173
-
 in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-4-[3-(3,4-dichlorophenyl)indan-1-yl]morpholine
1.8.1.12 0.2
-
 IC50 above 0.2 mM, in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-N-[3-(3,4-dichlorophenyl)indan-1-yl]acetamide
1.8.1.12 0.2
-
 IC50 above 0.2 mM, in 40 mM HEPES (pH 7.5), temperature not specified in the publication Trypanosoma brucei trans-N-[3-(3,4-dichlorophenyl)indan-1-yl]-4-methylbenzenesulfonamide