TDR Targets

Basic information

Technical information

TDR Targets ID: 136949
Name: 2,4-dimethyl-7-phenylpyrazolo[1,5-a][1,3,5]tr iazine
MW: 224.261 | Formula: C13H12N4
H donors: 0 H acceptors: 3 LogP: 2.56 Rotable bonds: 1
Rule of 5 violations (Lipinski): 1
SMILES: Cc1nc(C)nc2n1nc(c2)c1ccccc1
InChi: 1S/C13H12N4/c1-9-14-10(2)17-13(15-9)8-12(16-17)11-6-4-3-5-7-11/h3-8H,1-2H3
InChiKey: KLTGICMLKIWXMJ-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

2,4-dimethyl-7-phenyl-pyrazolo[1,5-a][1,3,5]triazine

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
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0025	0.149	0.3241
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Schistosoma mansoni	dihydrofolate reductase	0.0104	1	1
Toxoplasma gondii	FATC domain-containing protein	0.0025	0.149	0.4888
Echinococcus multilocularis	dihydrofolate reductase	0.0104	1	1
Plasmodium vivax	bifunctional dihydrofolate reductase-thymidylate synthase, putative	0.004	0.3048	0.5
Leishmania major	phosphatidylinositol kinase related protein, putative	0.0018	0.0747	0.0017
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Echinococcus multilocularis	serine protein kinase ATM	0.0025	0.149	0.0807
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Toxoplasma gondii	bifunctional dihydrofolate reductase-thymidylate synthase	0.004	0.3048	1
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0018	0.0743	0.2438
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trypanosoma brucei	dihydrofolate reductase-thymidylate synthase	0.004	0.3048	1
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0025	0.149	0.0807
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0018	0.0743	0.2438
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0018	0.0743	0.2438
Giardia lamblia	GTOR	0.0018	0.0743	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Loa Loa (eye worm)	phosphatidylinositol 3	0.0018	0.0743	0.0743
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0018	0.0747	0.0017
Loa Loa (eye worm)	dihydrofolate reductase	0.0104	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0018	0.0743	0.2438
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Leishmania major	dihydrofolate reductase-thymidylate synthase	0.004	0.3048	1
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0018	0.0743	0.2438
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Chlamydia trachomatis	dihydrofolate reductase	0.0104	1	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Mycobacterium ulcerans	dihydrofolate reductase DfrA	0.0104	1	0.5
Brugia malayi	Dihydrofolate reductase	0.0104	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.149	1
Mycobacterium tuberculosis	Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase)	0.0104	1	0.5
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase	0.004	0.3048	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Plasmodium falciparum	bifunctional dihydrofolate reductase-thymidylate synthase	0.004	0.3048	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Echinococcus granulosus	serine protein kinase ATM	0.0025	0.149	0.0807
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0022	0.1105	0.1571
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Entamoeba histolytica	hypothetical protein	0.0025	0.149	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Loa Loa (eye worm)	hypothetical protein	0.0022	0.1105	0.1105
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0025	0.149	0.0807
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Mycobacterium leprae	DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE)	0.0104	1	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.0743	0.4987
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0025	0.149	0.4888
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0018	0.0743	0.2438
Loa Loa (eye worm)	phosphatidylinositol 3	0.0018	0.0743	0.0743
Echinococcus granulosus	dihydrofolate reductase	0.0104	1	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (binding)	= 3.5	Inhibitory activity towards cAMP phosphodiesterase isolated from bovine heart.	ChEMBL.	6279842
Activity (binding)	= 19	Inhibition of bovine brain cAMP Phosphodiesterase	ChEMBL.	6279842
Activity (binding)	= 22	Inhibitory activity towards cAMP phosphodiesterase isolated from rabbit lung.	ChEMBL.	6279842

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

PubChem: 12913972

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.

Detailed information for compound 136949