Detailed information for compound 1600799

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 244.145 | Formula: C7H9N4O4P
  • H donors: 3 H acceptors: 5 LogP: -2.43 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=c1[nH]cnc2c1ncn2CCP(=O)(O)O
  • InChi: 1S/C7H9N4O4P/c12-7-5-6(8-3-9-7)11(4-10-5)1-2-16(13,14)15/h3-4H,1-2H2,(H,8,9,12)(H2,13,14,15)
  • InChiKey: DIXJABWSJWXYPQ-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens hypoxanthine phosphoribosyltransferase 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma brucei gambiense hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma brucei hypoxanthine-guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma congolense hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Trichomonas vaginalis hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Plasmodium berghei hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma brucei gambiense hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Toxoplasma gondii hypoxanthine-xanthine-guanine phosphoribosyl transferase HXGPRT Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Leishmania major xanthine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Leishmania mexicana hypoxanthine-guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Schistosoma mansoni hypoxanthine-guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Schistosoma japonicum Hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma congolense hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Leishmania braziliensis hypoxanthine-guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma congolense hypoxanthine-guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Leishmania braziliensis xanthine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Echinococcus granulosus hypoxanthine guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Mycobacterium ulcerans hypoxanthine-guanine phosphoribosyltransferase Hpt Get druggable targets OG5_127374 All targets in OG5_127374
Leishmania infantum hypoxanthine-guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Neospora caninum Hypoxanthine phosphoribosyltransferase (EC 2.4.2.8), related Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Plasmodium knowlesi hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Giardia lamblia Guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Leishmania donovani xanthine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Mycobacterium leprae Probable hypoxanthine-guanine phosphoribosyltransferase Hpt (HGPRT) (HGPRTase) (hypoxanthine phosphoribosyltransferase) (IMP pho Get druggable targets OG5_127374 All targets in OG5_127374
Brugia malayi Phosphoribosyl transferase domain containing protein Get druggable targets OG5_127374 All targets in OG5_127374
Plasmodium falciparum hypoxanthine-guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma brucei gambiense hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Leishmania donovani hypoxanthine-guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Echinococcus granulosus hypoxanthine guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Leishmania major hypoxanthine-guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Leishmania mexicana xanthine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Echinococcus multilocularis hypoxanthine guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Plasmodium vivax hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Schistosoma mansoni hypoxanthine-guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Leishmania infantum xanthine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Schistosoma japonicum ko:K00760 hypoxanthine phosphoribosyltransferase [EC2.4.2.8], putative Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Echinococcus multilocularis hypoxanthine guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Mycobacterium tuberculosis Hypoxanthine-guanine phosphoribosyltransferase Hpt (HGPRT) (HGPRTase) (hypoxanthine phosphoribosyltransferase) (imp pyrophosphor Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma brucei hypoxanthine-guanine phosphoribosyltransferase Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma brucei hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative Get druggable targets OG5_127374 All targets in OG5_127374
Onchocerca volvulus Get druggable targets OG5_127374 All targets in OG5_127374

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
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trypanosoma cruzi target of rapamycin kinase 3 0.0475 0.0449 0.1352
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0475 0.0449 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0268 0.0138 0.2269
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0475 0.0449 0.0405
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0475 0.0449 0.1352
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0475 0.0449 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0475 0.0449 1
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0475 0.0449 1
Echinococcus granulosus serine:threonine protein kinase SMG1 0.0268 0.0138 0.0092
Loa Loa (eye worm) hypothetical protein 0.0298 0.0184 0.4087
Loa Loa (eye worm) hypothetical protein 0.0268 0.0138 0.3062
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0475 0.0449 0.1352
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0268 0.0138 0.0414
Leishmania major hypothetical protein, conserved 0.2474 0.3462 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0475 0.0449 1
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0298 0.0184 0.1478
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0475 0.0449 0.1352
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.0268 0.0138 0.0092
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0268 0.0138 0.2269
Trichomonas vaginalis PIKK family atypical protein kinase 0.0268 0.0138 0.3062
Echinococcus multilocularis DNA dependent protein kinase catalytic subunit 0.6812 1 1
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0475 0.0449 0.0405
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0475 0.0449 1
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0475 0.0449 0.0405
Schistosoma mansoni fkbp-rapamycin associated protein 0.0268 0.0138 0.2269
Giardia lamblia GTOR 0.0475 0.0449 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis conserved hypothetical protein 0.0207 0.0046 0.1025
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0268 0.0138 0.3062
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0268 0.0138 0.3062
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis conserved hypothetical protein 0.0298 0.0184 0.4087
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0475 0.0449 1
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0268 0.0138 0.3062
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Echinococcus multilocularis serine protein kinase ATM 0.0268 0.0138 0.0092
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Toxoplasma gondii target of rapamycin (TOR), putative 0.0475 0.0449 1
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0475 0.0449 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Echinococcus granulosus serine protein kinase ATM 0.0268 0.0138 0.0092
Trypanosoma cruzi hypothetical protein, conserved 0.2382 0.3325 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0268 0.0138 0.3062
Trichomonas vaginalis PIKK family atypical protein kinase 0.0268 0.0138 0.3062
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0475 0.0449 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0268 0.0138 0.3062
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0268 0.0138 0.0414
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Toxoplasma gondii non-specific serine/threonine protein kinase 0.0298 0.0184 0.1478
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0475 0.0449 1
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0475 0.0449 0.0405
Trichomonas vaginalis PIKK family atypical protein kinase 0.0298 0.0184 0.4087
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Loa Loa (eye worm) hypothetical protein 0.0207 0.0046 0.1025
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0475 0.0449 0.1352
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0268 0.0138 0.2269
Trichomonas vaginalis PIKK family atypical protein kinase 0.0268 0.0138 0.3062
Trichomonas vaginalis PIKK family atypical protein kinase 0.0475 0.0449 1

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 3.4 uM Inhibition of human HGPRT ChEMBL. 22178188

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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