Detailed information for compound 1074436

Basic information

Technical information
  • TDR Targets ID: 1074436
  • Name: 3-[(3,5-diethyl-1H-pyrazol-4-yl)oxy]benzonitr ile
  • MW: 241.288 | Formula: C14H15N3O
  • H donors: 1 H acceptors: 2 LogP: 3.13 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#Cc1cccc(c1)Oc1c(CC)[nH]nc1CC
  • InChi: 1S/C14H15N3O/c1-3-12-14(13(4-2)17-16-12)18-11-7-5-6-10(8-11)9-15/h5-8H,3-4H2,1-2H3,(H,16,17)
  • InChiKey: HRPRBPIOFNXWBZ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

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
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0019 0.0241 0.4987
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.007 0.2037 0.2945
Mycobacterium ulcerans aldehyde dehydrogenase 0.007 0.2037 0.5
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0053 0.1434 0.3182
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.007 0.2037 1
Brugia malayi TAR-binding protein 0.0073 0.2143 0.5073
Onchocerca volvulus Huntingtin homolog 0.0126 0.3989 1
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0056 0.1541 0.2132
Echinococcus multilocularis tar DNA binding protein 0.0073 0.2143 0.3118
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.1434 0.1222
Toxoplasma gondii aldehyde dehydrogenase 0.007 0.2037 1
Loa Loa (eye worm) hypothetical protein 0.0049 0.1304 0.3269
Brugia malayi mbt repeat family protein 0.0049 0.1304 0.2836
Leishmania major phosphatidylinositol kinase related protein, putative 0.0019 0.0242 0.0007
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0019 0.0241 0.4987
Echinococcus granulosus serine protein kinase ATM 0.0025 0.0484 0.0398
Echinococcus granulosus tar DNA binding protein 0.0073 0.2143 0.3118
Schistosoma mansoni tar DNA-binding protein 0.0073 0.2143 0.1948
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0073 0.2143 0.5371
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Schistosoma mansoni myelin transcription factor 1 myt1 0.0056 0.1541 0.1332
Echinococcus multilocularis serine protein kinase ATM 0.0025 0.0484 0.0398
Onchocerca volvulus Huntingtin homolog 0.0126 0.3989 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0121 0.384 0.9626
Loa Loa (eye worm) phosphatidylinositol 3 0.0019 0.0241 0.0605
Entamoeba histolytica hypothetical protein 0.0025 0.0484 1
Echinococcus granulosus SAM and MBT domain containing protein 0.0049 0.1304 0.1743
Loa Loa (eye worm) hypothetical protein 0.0056 0.1541 0.3863
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0049 0.1304 0.1089
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.0025 0.0484 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Loa Loa (eye worm) phosphatidylinositol 3 0.0019 0.0241 0.0605
Loa Loa (eye worm) hypothetical protein 0.0126 0.3989 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Brugia malayi RNA recognition motif domain containing protein 0.0073 0.2143 0.5073
Schistosoma mansoni tar DNA-binding protein 0.0073 0.2143 0.1948
Mycobacterium ulcerans aldehyde dehydrogenase 0.007 0.2037 0.5
Brugia malayi RNA binding protein 0.0073 0.2143 0.5073
Echinococcus granulosus polycomb protein SCMH1 0.0049 0.1304 0.1743
Mycobacterium ulcerans aldehyde dehydrogenase 0.007 0.2037 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.1434 0.1222
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Loa Loa (eye worm) hypothetical protein 0.0126 0.3989 1
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0019 0.0241 0.4987
Loa Loa (eye worm) mbt repeat family protein 0.0049 0.1304 0.3269
Echinococcus multilocularis SAM and MBT domain containing protein 0.0049 0.1304 0.1743
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0193 0.6339 1
Echinococcus multilocularis polycomb protein SCMH1 0.0049 0.1304 0.1743
Schistosoma mansoni tar DNA-binding protein 0.0073 0.2143 0.1948
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Schistosoma mansoni tar DNA-binding protein 0.0073 0.2143 0.1948
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0025 0.0484 0.0248
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0053 0.1434 0.3594
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Schistosoma mansoni aldehyde dehydrogenase 0.007 0.2037 0.184
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0019 0.0242 0.0052
Schistosoma mansoni tar DNA-binding protein 0.0073 0.2143 0.1948
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Loa Loa (eye worm) TAR-binding protein 0.0073 0.2143 0.5371
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0019 0.0241 0.4987
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Echinococcus multilocularis histone acetyltransferase MYST2 0.0056 0.1541 0.2132
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.007 0.2037 0.5
Toxoplasma gondii FATC domain-containing protein 0.0025 0.0484 0.2375
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Toxoplasma gondii target of rapamycin (TOR), putative 0.0019 0.0241 0.1184
Loa Loa (eye worm) MBCTL1 0.0056 0.1541 0.3863
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.1434 0.1956
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0056 0.1541 0.3468
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0019 0.0241 0.4987
Brugia malayi mbt repeat family protein 0.0049 0.1304 0.2836
Loa Loa (eye worm) RNA binding protein 0.0073 0.2143 0.5371
Echinococcus granulosus histone acetyltransferase MYST2 0.0056 0.1541 0.2132
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.1304 0.1089
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0193 0.6339 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Giardia lamblia GTOR 0.0019 0.0241 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.007 0.2037 0.2945
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0025 0.0484 0.0647
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.1434 0.1956
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.1434 0.1956
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0025 0.0484 1
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0022 0.0359 0.4849
Brugia malayi hypothetical protein 0.0126 0.3989 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.1434 0.1222
Brugia malayi MH2 domain containing protein 0.0121 0.384 0.9602
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0056 0.1541 0.2132
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.1434 0.1956
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Loa Loa (eye worm) transcription factor SMAD2 0.0121 0.384 0.9626
Trichomonas vaginalis PIKK family atypical protein kinase 0.0019 0.0241 0.4987
Schistosoma mansoni aldehyde dehydrogenase 0.007 0.2037 0.184
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0484 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0359 0.0899
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.1304 0.1089

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.

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