TDR Targets

Basic information

Technical information

TDR Targets ID: 618805
Name: 2-[(5-methyl-[1,2,4]triazolo[4,5-a]quinolin-1 -yl)sulfanyl]-N-(4-sulfamoylphenyl)acetamide
MW: 427.5 | Formula: C19H17N5O3S2
H donors: 2 H acceptors: 5 LogP: 3.19 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc2n1c1ccccc1c(c2)C
InChi: 1S/C19H17N5O3S2/c1-12-10-17-22-23-19(24(17)16-5-3-2-4-15(12)16)28-11-18(25)21-13-6-8-14(9-7-13)29(20,26)27/h2-10H,11H2,1H3,(H,21,25)(H2,20,26,27)
InChiKey: CLGWQRAUCWDBSG-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

2-[(5-methyl-[1,2,4]triazolo[4,5-a]quinolin-1-yl)thio]-N-(4-sulfamoylphenyl)acetamide
2-[(5-methyl-[1,2,4]triazolo[4,5-a]quinolin-1-yl)sulfanyl]-N-(4-sulfamoylphenyl)ethanamide
ChemDiv1_001883
T0501-3976

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

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Leishmania major	aldehyde reductase, putative,oxidoreductase, putative	0.014	1	1
Giardia lamblia	Aldose reductase	0.014	1	1
Plasmodium falciparum	aldo-keto reductase, putative	0.004	0.1787	1
Loa Loa (eye worm)	glutamate-cysteine ligase modifier subunit	0.004	0.1787	0.1787
Echinococcus granulosus	thioredoxin glutathione reductase	0.0038	0.1622	0.1622
Trichomonas vaginalis	aldo/keto reductase, putative	0.014	1	1
Echinococcus multilocularis	aldo keto reductase	0.014	1	1
Onchocerca volvulus		0.014	1	1
Schistosoma mansoni	hypothetical protein	0.0036	0.1427	0.1427
Echinococcus multilocularis	aldo keto reductase	0.014	1	1
Leishmania major	aldo-keto reductase-like protein	0.014	1	1
Trypanosoma cruzi	aldo/keto reductase, putative	0.014	1	1
Leishmania major	aldo/keto reductase, putative,aldo/keto reductase family-like protein	0.004	0.1787	0.1787
Trypanosoma brucei	trypanothione reductase	0.0038	0.158	0.158
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0087	0.5607	0.4651
Entamoeba histolytica	alcohol dehydrogenase, putative	0.004	0.1787	0.1787
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0087	0.5607	0.5607
Entamoeba histolytica	hypothetical protein	0.0036	0.1427	0.1427
Onchocerca volvulus		0.014	1	1
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Trichomonas vaginalis	aldo/keto reductase, putative	0.014	1	1
Echinococcus multilocularis	aldo keto reductase	0.014	1	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.014	1	1
Loa Loa (eye worm)	oxidoreductase	0.014	1	1
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0087	0.5607	0.5607
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.014	1	1
Schistosoma mansoni	aldo-keto reductase	0.014	1	1
Echinococcus granulosus	aldo keto reductase family 1, member B4	0.004	0.1787	0.1787
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.014	1	1
Mycobacterium tuberculosis	Probable reductase	0.0087	0.5607	0.5607
Echinococcus granulosus	voltage gated potassium channel subunit	0.004	0.1787	0.1787
Echinococcus granulosus	hypothetical protein	0.014	1	1
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.014	1	1
Toxoplasma gondii	aldo/keto reductase family oxidoreductase	0.004	0.1787	0.1787
Brugia malayi	glutamate-cysteine ligase modifier subunit	0.004	0.1787	0.1787
Plasmodium vivax	thioredoxin reductase, putative	0.0038	0.158	0.8845
Plasmodium vivax	glutathione reductase, putative	0.0038	0.158	0.8845
Plasmodium vivax	aldehyde reductase, putative	0.004	0.1787	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.014	1	1
Echinococcus multilocularis	voltage gated potassium channel subunit	0.004	0.1787	0.1787
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Entamoeba histolytica	hypothetical protein	0.0036	0.1427	0.1427
Loa Loa (eye worm)	oxidoreductase	0.014	1	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.014	1	1
Trypanosoma cruzi	aldo/keto reductase, putative	0.004	0.1787	0.1787
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.014	1	1
Trichomonas vaginalis	aldo-keto reductase, putative	0.004	0.1787	0.1787
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0096	0.6406	0.6406
Trichomonas vaginalis	aldo/keto reductase, putative	0.014	1	1
Trichomonas vaginalis	alcohol dehydrogenase, putative	0.004	0.1787	0.1787
Loa Loa (eye worm)	hypothetical protein	0.014	1	1
Plasmodium falciparum	aldehyde reductase, putative	0.004	0.1787	1
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0087	0.5607	0.5607
Onchocerca volvulus		0.014	1	1
Echinococcus multilocularis	aldehyde reductase	0.0099	0.6651	0.6651
Echinococcus granulosus	aldehyde reductase	0.0099	0.6651	0.6651
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Loa Loa (eye worm)	oxidoreductase	0.014	1	1
Loa Loa (eye worm)	thioredoxin reductase	0.0038	0.158	0.158
Echinococcus granulosus	aldo keto reductase	0.014	1	1
Mycobacterium leprae	Conserved hypothetical protein	0.0099	0.6651	0.5922
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Mycobacterium ulcerans	hypothetical protein	0.004	0.1787	0.1787
Schistosoma mansoni	pol-related	0.014	1	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.014	1	1
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.014	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.004	0.1787	0.1787
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.014	1	1
Trypanosoma cruzi	aldo-keto reductase	0.014	1	1
Mycobacterium leprae	PROBABLE OXIDOREDUCTASE	0.014	1	1
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0038	0.158	0.158
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.014	1	1
Loa Loa (eye worm)	oxidoreductase	0.014	1	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.014	1	1
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.014	1	1
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0	0.5
Entamoeba histolytica	alcohol dehydrogenase, putative	0.004	0.1787	0.1787
Mycobacterium tuberculosis	Probable oxidoreductase	0.0096	0.6406	0.6406
Brugia malayi	Thioredoxin reductase	0.0038	0.158	0.158
Plasmodium falciparum	thioredoxin reductase	0.0038	0.158	0.8845
Leishmania major	prostaglandin f synthase, putative	0.014	1	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.014	1	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0036	0.1427	0.1427
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.014	1	1
Mycobacterium tuberculosis	Conserved protein	0.004	0.1787	0.1787
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.014	1	1
Entamoeba histolytica	hypothetical protein	0.0036	0.1427	0.1427
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Onchocerca volvulus		0.014	1	1
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0087	0.5607	0.5607
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0096	0.6406	0.5625
Mycobacterium ulcerans	oxidoreductase	0.014	1	1
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.014	1	1
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.014	1	1
Mycobacterium tuberculosis	Probable dehydrogenase	0.0087	0.5607	0.5607
Entamoeba histolytica	hypothetical protein	0.0036	0.1427	0.1427
Trypanosoma brucei	prostaglandin f synthase	0.014	1	1
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.014	1	1
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.014	1	1
Leishmania major	prostaglandin f2-alpha synthase/D-arabinose dehydrogenase	0.014	1	1
Entamoeba histolytica	aldose reductase, putative	0.014	1	1
Onchocerca volvulus		0.014	1	1
Schistosoma mansoni	transcription factor LCR-F1	0.0036	0.1427	0.1427
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Trypanosoma brucei	aldo-keto reductase, putative	0.014	1	1
Schistosoma mansoni	potassium channel beta	0.004	0.1787	0.1787
Giardia lamblia	Aldose reductase	0.014	1	1
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.014	1	1
Leishmania major	trypanothione reductase	0.0038	0.158	0.158
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.014	1	1
Entamoeba histolytica	aldose reductase, putative	0.014	1	1
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Onchocerca volvulus		0.014	1	1
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0096	0.6406	0.6406
Toxoplasma gondii	aldose reductase, putative	0.014	1	1
Echinococcus granulosus	aldo keto reductase	0.014	1	1
Trichomonas vaginalis	aldo-keto reductase, putative	0.004	0.1787	0.1787
Plasmodium vivax	oxidoreductase, aldo/keto reductase domain containing protein	0.004	0.1787	1
Toxoplasma gondii	aldo-keto reductase	0.004	0.1787	0.1787
Entamoeba histolytica	aldose reductase, putative	0.014	1	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0036	0.1427	0.1427
Loa Loa (eye worm)	glutathione reductase	0.0038	0.158	0.158
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.014	1	1
Trypanosoma brucei	aldo/keto reductase, putative	0.004	0.1787	0.1787
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.014	1	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.014	1	1
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0	0.5
Brugia malayi	hypothetical protein	0.0036	0.1427	0.1427
Toxoplasma gondii	oxidoreductase, aldo/keto reductase family protein	0.004	0.1787	0.1787
Echinococcus multilocularis	aldo keto reductase	0.014	1	1
Trichomonas vaginalis	aldo-keto reductase, putative	0.004	0.1787	0.1787
Brugia malayi	NADH-dependent xylose reductase	0.004	0.1787	0.1787
Echinococcus granulosus	aldo keto reductase	0.014	1	1
Toxoplasma gondii	thioredoxin reductase	0.0038	0.158	0.158
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.014	1	1
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Loa Loa (eye worm)	oxidoreductase	0.014	1	1
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.014	1	1
Schistosoma mansoni	aldo-keto reductase	0.014	1	1
Brugia malayi	glutathione reductase	0.0038	0.158	0.158
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0038	0.1622	0.1622
Trypanosoma cruzi	trypanothione reductase, putative	0.0038	0.158	0.158
Trichomonas vaginalis	aldo-keto reductase, putative	0.014	1	1
Plasmodium falciparum	glutathione reductase	0.0038	0.158	0.8845

Activities

No activities found for this compound.

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

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 618805