Detailed information for compound 210488

Basic information

Technical information
  • TDR Targets ID: 210488
  • Name: 5-methyl-2H-[1,2,4]triazolo[4,3-a]quinoxaline -1,4-dione
  • MW: 216.196 | Formula: C10H8N4O2
  • H donors: 1 H acceptors: 4 LogP: 0.49 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=c1c2nnc(n2c2c(n1C)cccc2)O
  • InChi: 1S/C10H8N4O2/c1-13-6-4-2-3-5-7(6)14-8(9(13)15)11-12-10(14)16/h2-5H,1H3,(H,12,16)
  • InChiKey: ZUVSEHTWVYMKNE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 5-methyl-2H-[1,2,4]triazolo[4,3-a]quinoxaline-1,4-quinone
  • RHC 2851
  • 5-methyl-2H-[1,2,4]triazolo[5,4-c]quinoxaline-1,4-dione
  • 5-methyl-2H-[1,2,4]triazolo[5,4-c]quinoxaline-1,4-quinone
  • 80708-30-1
  • (1,2,4)Triazolo(4,3-a)quinoxaline-1,4(2H,5H)-dione, 5-methyl-
  • Rhc-2851

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0021 0.0021
Echinococcus granulosus BRK domain containing protein 0.0013 0.0067 0.0108
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0594 1 1
Schistosoma mansoni dihydropyridine-sensitive l-type calcium channel 0.0162 0.2612 1
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0021 0.0034
Trypanosoma cruzi hypothetical protein, conserved 0.0183 0.2977 1
Trypanosoma brucei low molecular weight protein tyrosine phosphatase, putative 0.0183 0.2977 1
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0021 0.0021
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0324 1
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0067 0.0108
Loa Loa (eye worm) hypothetical protein 0.0033 0.0417 0.0417
Echinococcus granulosus family C2 unassigned peptidase C02 family 0.0068 0.1013 0.1638
Brugia malayi steroid hormone receptor 0.001 0.0021 0.0021
Schistosoma mansoni hypothetical protein 0.0013 0.0067 0.0257
Echinococcus granulosus FTZ F1 alpha 0.001 0.0021 0.0034
Toxoplasma gondii SWI2/SNF2 Brahma-like putative 0.0014 0.0079 0.2425
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0021 0.0034
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0021 0.0034
Schistosoma mansoni thyroid hormone receptor 0.001 0.0021 0.0081
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0068 0.1013 0.3879
Brugia malayi N-terminal motif family protein 0.0182 0.2957 0.2957
Loa Loa (eye worm) hypothetical protein 0.001 0.0021 0.0021
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0324 0.0525
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0021 0.0081
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0021 0.0021
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0067 0.0108
Echinococcus multilocularis BRK domain 0.0013 0.0067 0.0108
Brugia malayi calpain 7 0.0019 0.0177 0.0177
Onchocerca volvulus 0.0594 1 1
Echinococcus multilocularis voltage dependent calcium channel subunit 0.0371 0.6185 1
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0021 0.0034
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0594 1 1
Loa Loa (eye worm) phosphotyrosine protein phosphatase 0.0594 1 1
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0594 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0635 0.2431
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0021 0.0034
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0021 0.0021
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0021 0.0034
Brugia malayi hypothetical protein 0.0018 0.0155 0.0155
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0021 0.0021
Loa Loa (eye worm) BRM protein 0.0048 0.0659 0.0659
Echinococcus multilocularis GPCR, family 2 0.0033 0.0417 0.0675
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0021 0.0021
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0106 0.1649 0.1649
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0324 1
Schistosoma mansoni serine-rich repeat protein 0.0087 0.1336 0.5114
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0182 0.2957 0.2957
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0594 1 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.1079 0.1079
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0594 1 1
Schistosoma mansoni hypothetical protein 0.0087 0.1336 0.5114
Schistosoma mansoni hypothetical protein 0.0072 0.1079 0.4131
Echinococcus granulosus GPCR family 2 0.0033 0.0417 0.0675
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0021 0.0021
Loa Loa (eye worm) calpain family protein 1 0.0046 0.0626 0.0626
Loa Loa (eye worm) calpain 0.0019 0.0177 0.0177
Schistosoma mansoni helicase 0.0074 0.1118 0.4281
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0324 0.0525
Loa Loa (eye worm) hypothetical protein 0.001 0.0021 0.0021
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0021 0.0021
Schistosoma mansoni hypothetical protein 0.0033 0.0417 0.1597
Schistosoma mansoni calpain (C02 family) 0.0019 0.0177 0.0678
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0021 0.0081
Echinococcus multilocularis calpain 7 (C02 family) 0.0019 0.0177 0.0286
Entamoeba histolytica hypothetical protein 0.011 0.1719 0.157
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0033 0.0417 0.0675
Echinococcus multilocularis hypothetical protein 0.0019 0.0177 0.0286
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0013 0.0061 0.0099
Loa Loa (eye worm) hypothetical protein 0.0106 0.1649 0.1649
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0635 0.1026
Schistosoma mansoni hypothetical protein 0.0033 0.0417 0.1597
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0021 0.0034
Schistosoma mansoni hypothetical protein 0.0013 0.0067 0.0256
Schistosoma mansoni hypothetical protein 0.0013 0.0061 0.0233
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0021 0.0021
Echinococcus multilocularis chromodomain helicase DNA binding protein 7 0.0013 0.0067 0.0108
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0635 0.0635
Loa Loa (eye worm) hypothetical protein 0.0046 0.0626 0.0626
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0635 0.1026
Loa Loa (eye worm) hypothetical protein 0.0065 0.0957 0.0957
Loa Loa (eye worm) helicase DNA-binding protein 0.0013 0.0067 0.0067
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0067 0.0108
Giardia lamblia Low molecular weight protein-tyrosine-phosphatase 0.0594 1 1
Onchocerca volvulus 0.001 0.0021 0.0021
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0021 0.0021
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0021 0.0081
Brugia malayi calpain family protein 1 0.0065 0.0957 0.0957
Mycobacterium ulcerans phosphotyrosine protein phosphatase PtpA 0.0594 1 0.5
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0021 0.0034
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0635 0.1026
Loa Loa (eye worm) hypothetical protein 0.0075 0.1123 0.1123
Leishmania major hypothetical protein, conserved 0.0183 0.2977 1
Echinococcus multilocularis global transcription activator snf2l2 0.0074 0.1118 0.1808
Trypanosoma cruzi hypothetical protein, conserved 0.0183 0.2977 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0021 0.0021
Loa Loa (eye worm) hypothetical protein 0.0046 0.0626 0.0626
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0635 0.1026
Loa Loa (eye worm) hypothetical protein 0.0182 0.2957 0.2957
Echinococcus multilocularis family C2 unassigned peptidase (C02 family) 0.0068 0.1013 0.1638
Brugia malayi ecdysteroid receptor 0.001 0.0021 0.0021
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0183 0.2977 0.2921
Brugia malayi latrophilin 2 splice variant baaae 0.0072 0.1079 0.1079
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0021 0.0021
Echinococcus multilocularis calpain 5 0.0019 0.0177 0.0286
Schistosoma mansoni hypothetical protein 0.0033 0.0417 0.1597
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0021 0.0021
Loa Loa (eye worm) hypothetical protein 0.0028 0.0324 0.0324
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0021 0.0081
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0021 0.0021
Onchocerca volvulus 0.0046 0.0626 0.0626
Echinococcus granulosus global transcription activator snf2l2 0.0074 0.1118 0.1808
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0021 0.0034
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0033 0.0417 0.0675
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0021 0.0034
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0106 0.1649 0.1649
Schistosoma mansoni calpain-7 (C02 family) 0.0019 0.0177 0.0678
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0021 0.0034
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0021 0.0021
Echinococcus granulosus calpain A 0.0068 0.1013 0.1638
Loa Loa (eye worm) calpain family protein 1 0.0065 0.0957 0.0957
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0635 0.0635
Loa Loa (eye worm) hypothetical protein 0.001 0.0021 0.0021
Brugia malayi calpain 5 0.0019 0.0177 0.0177
Loa Loa (eye worm) hypothetical protein 0.001 0.0021 0.0021
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0183 0.2977 0.2921
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0594 1 1
Plasmodium vivax calpain, putative 0.0019 0.0177 0.4736
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0021 0.0021
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0021 0.0081
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0068 0.1013 0.3879
Echinococcus granulosus voltage dependent calcium channel subunit 0.0371 0.6185 1
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0067 0.0108
Schistosoma mansoni calpain-7 (C02 family) 0.0019 0.0177 0.0678
Echinococcus multilocularis calpain A 0.0068 0.1013 0.1638
Echinococcus granulosus calpain 0.0019 0.0177 0.0286
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0021 0.0021
Entamoeba histolytica Rad52/22 family double-strand break repair protein, putative 0.011 0.1719 0.157
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0021 0.0021
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0021 0.0021
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0065 0.0957 0.3662
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0021 0.0034
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0021 0.0034
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0635 0.2431
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0635 0.2431
Brugia malayi Associated with TFs and helicases family protein 0.0013 0.0067 0.0067
Toxoplasma gondii SWI2/SNF2 Brahma-like putative 0.0012 0.0045 0.1388
Echinococcus granulosus calpain 5 0.0019 0.0177 0.0286
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0021 0.0021
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0021 0.0021
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0033 0.0417 0.0675
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0324 1
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0021 0.0081
Brugia malayi nuclear hormone receptor 0.001 0.0021 0.0021
Schistosoma mansoni dihydropyridine-sensitive l-type calcium channel 0.0082 0.1241 0.4751
Loa Loa (eye worm) BRM protein 0.0038 0.0504 0.0504
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0021 0.0021
Loa Loa (eye worm) hypothetical protein 0.001 0.0021 0.0021
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0021 0.0034
Schistosoma mansoni thyroid hormone receptor 0.001 0.0021 0.0081
Loa Loa (eye worm) hypothetical protein 0.0065 0.0957 0.0957
Loa Loa (eye worm) hypothetical protein 0.001 0.0021 0.0021
Echinococcus granulosus calpain A 0.0019 0.0177 0.0286
Loa Loa (eye worm) hypothetical protein 0.001 0.0021 0.0021
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0021 0.0021
Schistosoma mansoni coup transcription factor 0.001 0.0021 0.0081
Brugia malayi nuclear receptor NHR-88 0.001 0.0021 0.0021
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0033 0.0417 0.0417
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0021 0.0081
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.0324 0.0525
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0594 1 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0033 0.0417 0.0417
Echinococcus multilocularis calpain family protein 1, d 0.0046 0.0626 0.1013
Brugia malayi Calcitonin receptor-like protein seb-1 0.0106 0.1649 0.1649
Schistosoma mansoni Mername-AA248 (C02 family) 0.0019 0.0177 0.0678
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0021 0.0021
Echinococcus granulosus voltage dependent calcium channel subunit 0.0169 0.273 0.4413
Entamoeba histolytica DNA repair and recombination protein RAD52, putative 0.0385 0.6427 0.6362
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0324 1
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0067 0.0108
Leishmania major hypothetical protein, conserved 0.0028 0.0324 0.0525
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0021 0.0021
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0021 0.0081
Echinococcus granulosus Chromo domain 0.0013 0.0067 0.0109
Mycobacterium tuberculosis Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase) 0.0411 0.687 0.5
Schistosoma mansoni nuclear hormone receptor 0.001 0.0021 0.0081
Brugia malayi hypothetical protein 0.0028 0.0324 0.0324
Brugia malayi BRM protein 0.0074 0.1118 0.1118
Echinococcus granulosus calpain 7 C02 family 0.0019 0.0177 0.0286
Schistosoma mansoni hypothetical protein 0.0033 0.0417 0.1597
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0021 0.0021
Brugia malayi Cache domain containing protein 0.0075 0.1123 0.1123
Echinococcus multilocularis calpain 0.0019 0.0177 0.0286
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0021 0.0081
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0067 0.0108
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0033 0.0417 0.0675
Brugia malayi calpain family protein 1 0.0065 0.0957 0.0957
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0021 0.0034
Brugia malayi Latrophilin receptor protein 2 0.0033 0.0417 0.0417
Echinococcus multilocularis voltage dependent calcium channel subunit 0.0169 0.273 0.4413
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0021 0.0034
Schistosoma mansoni calpain C (C02 family) 0.0019 0.0177 0.0678
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0021 0.0021
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0021 0.0021
Loa Loa (eye worm) calpain 5 0.0019 0.0177 0.0177
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0594 1 1
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0013 0.0061 0.0099
Echinococcus multilocularis Chromo domain 0.0013 0.0067 0.0109
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0021 0.0034

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 6 mg kg-1 Effective dose against IgE-mediated cutaneous anaphylaxis in the rat after peroral administration ChEMBL. 2579236
I50 (functional) = 40 uM Concentration required to inhibit Antigen-induced release of Histamine from rat mast cells ChEMBL. 2579236
Inhibition (functional) = 38 % Percent inhibitory activity in rat passive cutaneous anaphylaxis test at a dose of 25 mg/kg administered perorally ChEMBL. 2579236
Inhibition (functional) = 56 % Percent inhibitory activity in rat passive cutaneous anaphylaxis test at a dose of 10 mg/kg administered perorally ChEMBL. 2579236

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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