TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 258.299 | Formula: C12H10N4OS
H donors: 0 H acceptors: 4 LogP: 2.39 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: Cc1ccc(cc1)c1nnc(o1)c1snnc1C
InChi: 1S/C12H10N4OS/c1-7-3-5-9(6-4-7)11-14-15-12(17-11)10-8(2)13-16-18-10/h3-6H,1-2H3
InChiKey: ZWFIXZIUCLFROD-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

No synonyms found for this compound

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
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0016	0.0023	0.011
Schistosoma mansoni	hypothetical protein	0.0033	0.0819	0.383
Loa Loa (eye worm)	transcription factor SMAD2	0.0231	1	1
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0819	0.0819
Brugia malayi	isocitrate dehydrogenase	0.0015	0.0001	0.0001
Schistosoma mansoni	Smad4	0.0016	0.0023	0.011
Loa Loa (eye worm)	RNA binding protein	0.0062	0.2139	0.2139
Loa Loa (eye worm)	MH2 domain-containing protein	0.0016	0.0023	0.0023
Echinococcus granulosus	tar DNA binding protein	0.0062	0.2139	1
Brugia malayi	RNA binding protein	0.0062	0.2139	0.2139
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0015	0.0001	0.0005
Loa Loa (eye worm)	TAR-binding protein	0.0062	0.2139	0.2139
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0181	0.7666	0.5
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0015	0.0001	0.0005
Loa Loa (eye worm)	MH1 domain-containing protein	0.0016	0.0023	0.0023
Echinococcus multilocularis	smad	0.0016	0.0023	0.011
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2139	1
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0015	0.0001	0.0005
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0181	0.7666	1
Echinococcus granulosus	mothers against decapentaplegic 5	0.0016	0.0023	0.011
Echinococcus multilocularis	isocitrate dehydrogenase	0.0015	0.0001	0.0005
Brugia malayi	Smad1	0.0016	0.0023	0.0023
Schistosoma mansoni	smad1 5 8 and	0.0016	0.0023	0.011
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0181	0.7666	1
Giardia lamblia	Low molecular weight protein-tyrosine-phosphatase	0.0181	0.7666	0.5
Echinococcus granulosus	smad	0.0016	0.0023	0.011
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0048	0.1525	0.1525
Leishmania major	hypothetical protein, conserved	0.0056	0.1875	1
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0015	0.0001	0.0005
Mycobacterium ulcerans	phosphotyrosine protein phosphatase PtpA	0.0181	0.7666	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2139	1
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0015	0.0001	0.5
Loa Loa (eye worm)	Smad1	0.0016	0.0023	0.0023
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0015	0.0001	0.0005
Schistosoma mansoni	smad	0.0016	0.0023	0.011
Trypanosoma cruzi	hypothetical protein, conserved	0.0056	0.1875	1
Brugia malayi	Isocitrate dehydrogenase	0.0015	0.0001	0.0001
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0016	0.0023	0.011
Trypanosoma cruzi	hypothetical protein, conserved	0.0056	0.1875	1
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0181	0.7666	1
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2139	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0048	0.1525	0.1525
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.0015	0.0001	0.5
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0016	0.0023	0.011
Onchocerca volvulus		0.0181	0.7666	0.5
Loa Loa (eye worm)	hypothetical protein	0.0048	0.1525	0.1525
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0016	0.0023	0.011
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0048	0.1525	0.1525
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0015	0.0001	0.0005
Brugia malayi	MH2 domain containing protein	0.0016	0.0023	0.0023
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0181	0.7666	1
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0181	0.7666	0.5
Mycobacterium tuberculosis	Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase)	0.0125	0.5085	1
Brugia malayi	TAR-binding protein	0.0062	0.2139	0.2139
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0181	0.7666	1
Schistosoma mansoni	smad1 5 8 and	0.0016	0.0023	0.011
Loa Loa (eye worm)	MH2 domain-containing protein	0.0231	1	1
Brugia malayi	Low molecular weight phosphotyrosine protein phosphatase containing protein	0.0181	0.7666	0.7666
Echinococcus granulosus	Smad4	0.0016	0.0023	0.011
Toxoplasma gondii	isocitrate dehydrogenase	0.0015	0.0001	0.5
Trypanosoma brucei	low molecular weight protein tyrosine phosphatase, putative	0.0056	0.1875	1
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0015	0.0001	0.0001
Schistosoma mansoni	smad1 5 8 and	0.0016	0.0023	0.011
Brugia malayi	MH1 domain containing protein	0.0016	0.0023	0.0023
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2139	1
Echinococcus multilocularis	Smad4	0.0016	0.0023	0.011
Echinococcus multilocularis	tar DNA binding protein	0.0062	0.2139	1
Loa Loa (eye worm)	phosphotyrosine protein phosphatase	0.0181	0.7666	0.7666
Brugia malayi	MH1 domain containing protein	0.0016	0.0023	0.0023
Brugia malayi	RNA recognition motif domain containing protein	0.0062	0.2139	0.2139
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0181	0.7666	1
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0062	0.2139	0.2139
Toxoplasma gondii	isocitrate dehydrogenase	0.0015	0.0001	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2139	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.0819	0.0819
Brugia malayi	MH2 domain containing protein	0.0016	0.0023	0.0023

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

ChEMBL: CHEMBL2252693

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1815016