Detailed information for compound 2135327

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 281.112 | Formula: C11H15N5O4
  • H donors: 5 H acceptors: 7 LogP: -1.93 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 0
  • SMILES: OC[C@H]1N[C@H]([C@@H]([C@@H]1O)O)Cn1cnc2c1ncnc2O
  • InChi: InChI=1S/C11H15N5O4/c17-2-6-9(19)8(18)5(15-6)1-16-4-14-7-10(16)12-3-13-11(7)20/h3-6,8-9,15,17-19H,1-2H2,(H,12,13,20)/t5-,6+,8-,9+/m0/s1
  • InChiKey: YDNPJEMLQRXALS-JWIUVKOKSA-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
Trypanosoma brucei gambiense inosine-adenosine-guanosine-nucleosidehydrolase,IAG-nucleoside hydrolase References
Crithidia fasciculata Inosine-uridine preferring nucleoside hydrolase References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania braziliensis inosine-guanine nucleoside hydrolase, putative Get druggable targets OG5_127001 All targets in OG5_127001
Leishmania braziliensis nonspecific nucleoside hydrolase;with=GeneDB:LmjF18.1580 Get druggable targets OG5_127001 All targets in OG5_127001
Leishmania major nonspecific nucleoside hydrolase Get druggable targets OG5_127001 All targets in OG5_127001
Leishmania infantum inosine-guanine nucleoside hydrolase, putative Get druggable targets OG5_127001 All targets in OG5_127001
Leishmania braziliensis inosine-adenosine-guanosine-nucleoside hydrolase, putative Get druggable targets OG5_144830 All targets in OG5_144830
Candida albicans uridine ribohydrolase Get druggable targets OG5_127001 All targets in OG5_127001
Trypanosoma congolense nucleoside hydrolase, putative Get druggable targets OG5_127001 All targets in OG5_127001
Leishmania donovani nonspecific nucleoside hydrolasewith Get druggable targets OG5_127001 All targets in OG5_127001
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative Get druggable targets OG5_127001 All targets in OG5_127001
Trypanosoma cruzi inosine-guanine nucleoside hydrolase, putative Get druggable targets OG5_127001 All targets in OG5_127001
Mycobacterium tuberculosis Probable nucleoside hydrolase IunH (purine nucleosidase) Get druggable targets OG5_127001 All targets in OG5_127001
Giardia lamblia Hypothetical protein Get druggable targets OG5_127001 All targets in OG5_127001
Entamoeba histolytica Inosine-uridine preferring nucleoside hydrolase, putative Get druggable targets OG5_127001 All targets in OG5_127001
Leishmania infantum nonspecific nucleoside hydrolase;with=GeneDB:LmjF18.1580 Get druggable targets OG5_127001 All targets in OG5_127001
Trypanosoma cruzi inosine-adenosine-guanosine-nucleosidehydrolase, putative Get druggable targets OG5_144830 All targets in OG5_144830
Trypanosoma brucei gambiense nucleoside hydrolase, putative Get druggable targets OG5_127001 All targets in OG5_127001
Candida albicans uridine ribohydrolase Get druggable targets OG5_127001 All targets in OG5_127001
Leishmania donovani inosine-adenosine-guanosine-nucleosidehydrolase, putative Get druggable targets OG5_144830 All targets in OG5_144830
Trypanosoma cruzi inosine-adenosine-guanosine-nucleosidehydrolase, putative Get druggable targets OG5_144830 All targets in OG5_144830
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative Get druggable targets OG5_127001 All targets in OG5_127001
Trypanosoma brucei inosine-guanine nucleoside hydrolase Get druggable targets OG5_127001 All targets in OG5_127001
Trypanosoma congolense inosine-adenosine-guanosine-nucleosidehydrolase, putative Get druggable targets OG5_144830 All targets in OG5_144830
Leishmania infantum inosine-adenosine-guanosine-nucleoside hydrolase, putative Get druggable targets OG5_144830 All targets in OG5_144830
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative Get druggable targets OG5_127001 All targets in OG5_127001
Leishmania mexicana nonspecific nucleoside hydrolase Get druggable targets OG5_127001 All targets in OG5_127001
Leishmania mexicana Get druggable targets OG5_144830 All targets in OG5_144830
Trypanosoma brucei inosine-adenosine-guanosine-nucleosidehydrolase Get druggable targets OG5_144830 All targets in OG5_144830
Leishmania donovani nucleoside hydrolase-like protein Get druggable targets OG5_127001 All targets in OG5_127001
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative Get druggable targets OG5_127001 All targets in OG5_127001
Leishmania major inosine-adenosine-guanosine-nucleoside hydrolase, putative Get druggable targets OG5_144830 All targets in OG5_144830
Leishmania major inosine-guanine nucleoside hydrolase, putative Get druggable targets OG5_127001 All targets in OG5_127001
Leishmania mexicana nucleoside hydrolase-like protein Get druggable targets OG5_127001 All targets in OG5_127001
Trypanosoma brucei gambiense inosine-adenosine-guanosine-nucleosidehydrolase,IAG-nucleoside hydrolase Get druggable targets OG5_144830 All targets in OG5_144830

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
Trypanosoma brucei inosine-adenosine-guanosine-nucleosidehydrolase 0.0573 1 1
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative 0.0152 0 0.5
Giardia lamblia Hypothetical protein 0.0152 0 0.5
Entamoeba histolytica Inosine-uridine preferring nucleoside hydrolase, putative 0.0152 0 0.5
Trypanosoma cruzi inosine-adenosine-guanosine-nucleosidehydrolase, putative 0.0573 1 1
Mycobacterium tuberculosis Probable nucleoside hydrolase IunH (purine nucleosidase) 0.0152 0 0.5
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative 0.0152 0 0.5
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative 0.0152 0 0.5
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative 0.0152 0 0.5
Trypanosoma cruzi inosine-adenosine-guanosine-nucleosidehydrolase, putative 0.0573 1 1

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 3.6 uM Inhibition of Trypanosoma brucei brucei inosine-adenosine-guanosine nucleoside hydrolase expressed in Escherichia coli ChEMBL. 27128178
Ki (binding) = 5.4 uM Inhibition of Crithidia fasciculata inosine-uridine nucleoside hydrolase expressed in Escherichia coli using p-nitrophenyl beta-D-ribofuranoside as substrate by xanthine oxidase coupled enzyme assay ChEMBL. 27128178

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.