Detailed information for compound 1591636

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 377.247 | Formula: C11H16N5O8P
  • H donors: 5 H acceptors: 7 LogP: -3.55 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)COC(Cn1cnc2c1nc(N)[nH]c2=O)COCP(=O)(O)O
  • InChi: 1S/C11H16N5O8P/c12-11-14-9-8(10(19)15-11)13-4-16(9)1-6(24-3-7(17)18)2-23-5-25(20,21)22/h4,6H,1-3,5H2,(H,17,18)(H2,20,21,22)(H3,12,14,15,19)
  • InChiKey: YRDQHYTYGMNROH-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

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
Leishmania donovani hypoxanthine-guanine phosphoribosyltransferase 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
Leishmania major xanthine 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
Plasmodium berghei 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
Toxoplasma gondii hypoxanthine-xanthine-guanine phosphoribosyl transferase HXGPRT Get druggable targets OG5_127374 All targets in OG5_127374
Giardia lamblia Guanine phosphoribosyltransferase 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
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 cruzi hypoxanthine-guanine phosphoribosyltransferase, putative 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
Leishmania braziliensis xanthine phosphoribosyltransferase 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 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
Trypanosoma brucei gambiense 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
Leishmania donovani 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
Trypanosoma brucei 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
Echinococcus multilocularis hypoxanthine guanine phosphoribosyltransferase 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
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 xanthine 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
Plasmodium vivax hypoxanthine-guanine phosphoribosyltransferase, putative 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
Echinococcus granulosus 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
Trypanosoma brucei gambiense 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
Schistosoma japonicum ko:K00760 hypoxanthine phosphoribosyltransferase [EC2.4.2.8], putative 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 hypoxanthine-guanine phosphoribosyltransferase 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
Onchocerca volvulus 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
Mycobacterium leprae Probable hypoxanthine-guanine phosphoribosyltransferase Hpt (HGPRT) (HGPRTase) (hypoxanthine phosphoribosyltransferase) (IMP pho 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
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative 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
Treponema pallidum hypothetical protein 0.0026 0.0808 0.5
Onchocerca volvulus 0.0111 1 1
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative 0.0111 1 1
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative 0.0111 1 1
Schistosoma mansoni Adenine phosphoribosyltransferase 0.0026 0.0808 0.0808
Treponema pallidum phosphoribosylpyrophosphate synthetase 0.0026 0.0808 0.5
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative 0.0111 1 1
Plasmodium falciparum hypoxanthine-guanine phosphoribosyltransferase 0.0111 1 1
Schistosoma mansoni hypoxanthine-guanine phosphoribosyltransferase 0.0111 1 1
Brugia malayi orotate phosphoribosyltransferase family protein 0.0026 0.0808 0.0808
Schistosoma mansoni hypoxanthine-guanine phosphoribosyltransferase 0.0026 0.0808 0.0808
Echinococcus granulosus adenine phosphoribosyltransferase 0.0026 0.0808 0.0808
Echinococcus multilocularis uridine 5' monophosphate synthase 0.0026 0.0808 0.0808
Mycobacterium ulcerans hypoxanthine-guanine phosphoribosyltransferase Hpt 0.0111 1 1
Toxoplasma gondii hypoxanthine-xanthine-guanine phosphoribosyl transferase HXGPRT 0.0111 1 1
Onchocerca volvulus Adenine phosphoribosyltransferase homolog 0.0026 0.0808 0.0808
Treponema pallidum adenine phosphoribosyltransferase 0.0026 0.0808 0.5
Schistosoma mansoni uracil phosphoribosyltransferase 0.0026 0.0808 0.0808
Trypanosoma brucei hypoxanthine-guanine phosphoribosyltransferase, putative 0.0111 1 1
Echinococcus granulosus uridine 5' monophosphate synthase 0.0026 0.0808 0.0808
Echinococcus granulosus hypoxanthine guanine phosphoribosyltransferase 0.0111 1 1
Schistosoma mansoni hypoxanthine-guanine phosphoribosyltransferase 0.0026 0.0808 0.0808
Echinococcus multilocularis hypoxanthine guanine phosphoribosyltransferase 0.0111 1 1
Wolbachia endosymbiont of Brugia malayi orotate phosphoribosyltransferase 0.0026 0.0808 0.5
Loa Loa (eye worm) adenine phosphoribosyltransferase 0.0026 0.0808 1
Loa Loa (eye worm) orotate phosphoribosyltransferase 0.0026 0.0808 1
Mycobacterium leprae Probable hypoxanthine-guanine phosphoribosyltransferase Hpt (HGPRT) (HGPRTase) (hypoxanthine phosphoribosyltransferase) (IMP pho 0.0085 0.719 1
Echinococcus multilocularis hypoxanthine guanine phosphoribosyltransferase 0.0111 1 1
Giardia lamblia Guanine phosphoribosyltransferase 0.0111 1 1
Plasmodium vivax hypoxanthine-guanine phosphoribosyltransferase, putative 0.0111 1 1
Leishmania major hypoxanthine-guanine phosphoribosyltransferase 0.0111 1 1
Trichomonas vaginalis hypoxanthine-guanine phosphoribosyltransferase, putative 0.0111 1 1
Trypanosoma brucei hypoxanthine-guanine phosphoribosyltransferase 0.0111 1 1
Schistosoma mansoni hypoxanthine-guanine phosphoribosyltransferase 0.0111 1 1
Schistosoma mansoni Adenine phosphoribosyltransferase 0.0026 0.0808 0.0808
Echinococcus multilocularis adenine phosphoribosyltransferase 0.0026 0.0808 0.0808
Schistosoma mansoni orotidine 5'-phosphate decarboxylase 0.0026 0.0808 0.0808
Echinococcus granulosus hypoxanthine guanine phosphoribosyltransferase 0.0111 1 1
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative 0.0111 1 1
Brugia malayi Adenine phosphoribosyltransferase 0.0026 0.0808 0.0808
Wolbachia endosymbiont of Brugia malayi amidophosphoribosyltransferase 0.0026 0.0808 0.5
Trypanosoma brucei hypoxanthine-guanine phosphoribosyltransferase 0.0111 1 1
Mycobacterium tuberculosis Hypoxanthine-guanine phosphoribosyltransferase Hpt (HGPRT) (HGPRTase) (hypoxanthine phosphoribosyltransferase) (imp pyrophosphor 0.0085 0.719 1
Leishmania major xanthine phosphoribosyltransferase 0.0111 1 1

Activities

Activity type Activity value Assay description Source Reference
Inhibition (binding) Inhibition of human HGPRT at >= 30 uM by spectrophotometric analysis in presence of 52 uM PPi ChEMBL. 22249123
Ki (binding) = 5 uM Inhibition of human HGPRT by spectrophotometric analysis in absence of PPi ChEMBL. 22249123

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.

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