Detailed information for compound 1523816

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 208.303 | Formula: C9H8N2S2
  • H donors: 0 H acceptors: 0 LogP: 1.5 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: c1scc(c1)C1Cn2c(=N1)scc2
  • InChi: 1S/C9H8N2S2/c1-3-12-6-7(1)8-5-11-2-4-13-9(11)10-8/h1-4,6,8H,5H2
  • InChiKey: SIGNOZUHQRTIBR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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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
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Copper type II ascorbate-dependent monooxygenase, C-terminal domain containing protein 0.0367 0.4124 0.8348
Echinococcus multilocularis peptidyl glycine alpha amidating monooxygenase 0.0367 0.4124 0.3818
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0125 0.0765 0.1549
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0172 0.142 1
Brugia malayi Cyclin, N-terminal domain containing protein 0.0265 0.2716 0.5498
Leishmania major phosphatidylinositol 4-kinase, putative 0.0114 0.0616 0.1304
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0125 0.0765 0.1833
Loa Loa (eye worm) phosphatidylinositol 3 0.0125 0.0765 0.1549
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0172 0.142 1
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0172 0.142 0.2875
Schistosoma mansoni dopamine-beta-monooxygenase 0.0694 0.868 1
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0125 0.0765 0.0848
Loa Loa (eye worm) hypothetical protein 0.0367 0.4124 0.8348
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0125 0.0765 0.0848
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0425 0.494 1
Trichomonas vaginalis DNA-3-methyladenine glycosylase, putative 0.0335 0.368 1
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0125 0.0765 0.0848
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0125 0.0765 0.2919
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0125 0.0765 1
Loa Loa (eye worm) phosphofructokinase 0.0106 0.0495 0.1002
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0172 0.142 1
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0125 0.0765 0.0284
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0125 0.0765 0.033
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0125 0.0765 0.2919
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0125 0.0765 0.2919
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0425 0.494 1
Echinococcus multilocularis 0.0114 0.0616 0.0127
Loa Loa (eye worm) phosphatidylinositol 3 0.0425 0.494 1
Entamoeba histolytica hypothetical protein 0.0125 0.0765 0.2919
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0172 0.142 1
Onchocerca volvulus 0.0425 0.494 1
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0106 0.0495 0.5
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0114 0.0616 0.1304
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0125 0.0765 0.2919
Brugia malayi 6-phosphofructokinase 0.0106 0.0495 0.1002
Loa Loa (eye worm) cyclin domain-containing protein 0.0265 0.2716 0.5498
Loa Loa (eye worm) 6-phosphofructokinase 0.0106 0.0495 0.1002
Loa Loa (eye worm) hypothetical protein 0.0425 0.494 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0125 0.0765 0.1549
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0125 0.0765 0.2919
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0172 0.142 0.2875
Loa Loa (eye worm) hypothetical protein 0.0125 0.0765 0.1549
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0125 0.0765 0.2919
Brugia malayi 6-phosphofructokinase 0.0106 0.0495 0.1002
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0125 0.0765 0.2919
Mycobacterium tuberculosis Probable DNA-3-methyladenine glycosylase I TagA (tag I) (3-methyladenine-DNA glycosylase I, constitutive) (DNA-3-methyladenine g 0.0166 0.1333 1
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0125 0.0765 0.0608
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0172 0.1417 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0125 0.0765 0.2919
Mycobacterium leprae PROBABLE DNA-3-METHYLADENINE GLYCOSYLASE I TAGA (TAG I) (3-methyladenine-DNA glycosylase I, constitutive) (DNA-3-methyladenine g 0.0166 0.1333 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0114 0.0616 0.1304
Trichomonas vaginalis DNA-3-methyladenine glycosylase, putative 0.0335 0.368 1
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0172 0.142 0.2082
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0425 0.494 1
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0114 0.0616 0.1304
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0172 0.142 0.1131
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0125 0.0765 0.1549
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0125 0.0765 1
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0125 0.0765 0.033
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0172 0.142 0.0974
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0114 0.0616 0.1246
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0114 0.0616 0.0147
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0125 0.0765 0.0848
Loa Loa (eye worm) phosphatidylinositol kinase 0.0425 0.494 1
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0172 0.142 0.2906
Brugia malayi Copper type II ascorbate-dependent monooxygenase, C-terminal domain containing protein 0.0181 0.1536 0.3108
Schistosoma mansoni peptidylglycine monooxygenase 0.0367 0.4124 0.4433
Schistosoma mansoni peptidyl-glycine monooxygenase 0.0367 0.4124 0.4433
Schistosoma mansoni phosphatidylinositol 4-kinase type-II 0.0425 0.494 0.5431
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0125 0.0765 0.0848
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0125 0.0765 0.0608
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0425 0.494 1
Leishmania major phosphatidylinositol 3-kinase, putative 0.0125 0.0765 0.2919
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0425 0.494 0.4677
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0125 0.0765 0.0284
Loa Loa (eye worm) phosphatidylinositol 3 0.0425 0.494 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0125 0.0765 0.0848
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0125 0.0765 0.033
Echinococcus multilocularis Zinc finger, PHD finger 0.0125 0.0765 0.0284
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0125 0.0765 0.0848
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0172 0.142 0.2906
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0125 0.0765 1
Loa Loa (eye worm) 6-phosphofructokinase 0.0106 0.0495 0.1002
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0425 0.494 0.4677
Mycobacterium ulcerans DNA-3-methyladenine glycosylase I TagA 0.0335 0.368 1
Brugia malayi phosphofructokinase 0.0106 0.0495 0.1002
Loa Loa (eye worm) hypothetical protein 0.0367 0.4124 0.8348
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0125 0.0765 0.0848
Loa Loa (eye worm) phosphatidylinositol 3 0.0114 0.0616 0.1246
Echinococcus granulosus peptidyl glycine alpha amidating monooxygenase 0.0367 0.4124 0.8164
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0125 0.0765 0.2919
Onchocerca volvulus 0.0425 0.494 1
Brugia malayi Copper type II ascorbate-dependent monooxygenase, N-terminal domain containing protein 0.0186 0.1612 0.3263
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0125 0.0765 0.2919
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0125 0.0765 0.0848
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0172 0.142 1
Brugia malayi Copper type II ascorbate-dependent monooxygenase, C-terminal domain containing protein 0.0367 0.4124 0.8348
Echinococcus granulosus phosphatidylinositol 4 kinase beta 0.0114 0.0616 0.0272
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0125 0.0765 0.0608

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

Bibliographic References

No literature references available for this target.

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