Detailed information for compound 1245974

Basic information

Technical information
  • TDR Targets ID: 1245974
  • Name: 2-phenyl-N-pyridin-3-ylacetamide
  • MW: 212.247 | Formula: C13H12N2O
  • H donors: 1 H acceptors: 2 LogP: 1.62 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1cccnc1)Cc1ccccc1
  • InChi: 1S/C13H12N2O/c16-13(9-11-5-2-1-3-6-11)15-12-7-4-8-14-10-12/h1-8,10H,9H2,(H,15,16)
  • InChiKey: NYGIAKBYRXFSEN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-phenyl-N-(3-pyridyl)acetamide
  • 2-phenyl-N-pyridin-3-yl-ethanamide
  • 5221-39-6
  • Oprea1_006164
  • NSC160927
  • ST062516
  • ZINC00889044
  • MLS000708630
  • SMR000289197
  • Oprea1_508622
  • 2-Phenyl-N-pyridin-3-yl-acetamide
  • BAS 02953944

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
Schistosoma mansoni polyadenylate binding protein 0.0009 0.0126 0.0295
Onchocerca volvulus 0.0064 0.2049 0.1918
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0161 0.0161
Echinococcus multilocularis serotonin receptor 0.0128 0.4279 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0161 0.0377
Echinococcus granulosus polyadenylate binding protein 0.0009 0.0126 0.0295
Plasmodium vivax polyadenylate-binding protein, putative 0.0009 0.0126 0.5
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0161 0.0377
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0161 0.0377
Loa Loa (eye worm) hypothetical protein 0.001 0.0161 0.0161
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0161 0.0161
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0161 0.0161
Brugia malayi ecdysteroid receptor 0.001 0.0161 0.0161
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0161 0.0161
Leishmania major poly(A)-binding protein 3 0.0009 0.0126 0.5
Schistosoma mansoni coup transcription factor 0.001 0.0161 0.0377
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0161 0.0377
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0161 0.0377
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0161 0.0161
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0081 0.2658 0.6213
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0161 0.0377
Brugia malayi hypothetical protein 0.0064 0.2049 0.2049
Schistosoma mansoni thyroid hormone receptor 0.001 0.0161 0.0377
Trypanosoma brucei polyadenylate-binding protein 2 0.0009 0.0126 0.5
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0161 0.0377
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0161 0.0161
Echinococcus granulosus biogenic amine 5HT receptor 0.0128 0.4279 1
Trypanosoma cruzi polyadenylate-binding protein, putative 0.0009 0.0126 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 0.0126 0.0126
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0161 0.0161
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0161 0.0377
Schistosoma mansoni polyadenylate binding protein 0.0009 0.0126 0.0295
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0161 0.0161
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0161 0.0161
Trypanosoma brucei polyadenylate-binding protein 1 0.0009 0.0126 0.5
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0161 0.0377
Leishmania major poly(A)-binding protein 2 0.0009 0.0126 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.0161 0.0161
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0161 0.0377
Echinococcus multilocularis serotonin receptor 0.0128 0.4279 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0161 0.0161
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0161 0.0377
Loa Loa (eye worm) hypothetical protein 0.0292 1 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0161 0.0161
Loa Loa (eye worm) hypothetical protein 0.0128 0.4279 0.4279
Schistosoma mansoni biogenic amine (5HT) receptor 0.0128 0.4279 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0161 0.0161
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0161 0.0161
Schistosoma mansoni hypothetical protein 0.0066 0.2127 0.497
Echinococcus multilocularis jun protein 0.0081 0.2658 0.6213
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0161 0.0161
Schistosoma mansoni jun-related protein 0.0066 0.2127 0.497
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0161 0.0377
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0161 0.0161
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0161 0.0377
Loa Loa (eye worm) hypothetical protein 0.001 0.0161 0.0161
Echinococcus granulosus FTZ F1 alpha 0.001 0.0161 0.0377
Loa Loa (eye worm) hypothetical protein 0.0079 0.2581 0.2581
Brugia malayi polyadenylate-binding protein 1 0.0009 0.0126 0.0126
Schistosoma mansoni polyadenylate binding protein 0.0009 0.0126 0.0295
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0161 0.0377
Trypanosoma cruzi polyadenylate-binding protein 1, putative 0.0009 0.0126 0.5
Brugia malayi bZIP transcription factor family protein 0.0081 0.2658 0.2658
Echinococcus multilocularis polyadenylate binding protein 0.0009 0.0126 0.0295
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0161 0.0161
Loa Loa (eye worm) hypothetical protein 0.001 0.0161 0.0161
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0161 0.0377
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0161 0.0377
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0161 0.0377
Loa Loa (eye worm) hypothetical protein 0.001 0.0161 0.0161
Toxoplasma gondii polyadenylate binding protein, putative 0.0009 0.0126 0.5
Schistosoma mansoni thyroid hormone receptor 0.001 0.0161 0.0377
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0161 0.0161
Brugia malayi nuclear hormone receptor 0.001 0.0161 0.0161
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0161 0.0161
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0161 0.0161
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0161 0.0161
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0081 0.2658 0.6213
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0161 0.0377
Loa Loa (eye worm) hypothetical protein 0.001 0.0161 0.0161
Brugia malayi steroid hormone receptor 0.001 0.0161 0.0161
Onchocerca volvulus 0.0292 1 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0161 0.0377
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0161 0.0377
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0161 0.0161
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0161 0.0377
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0161 0.0377
Loa Loa (eye worm) hypothetical protein 0.001 0.0161 0.0161
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0161 0.0377
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0161 0.0377
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0161 0.0161
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0161 0.0377
Schistosoma mansoni nuclear hormone receptor 0.001 0.0161 0.0377
Loa Loa (eye worm) hypothetical protein 0.0128 0.4279 0.4279
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0161 0.0161
Echinococcus granulosus jun protein 0.0081 0.2658 0.6213
Brugia malayi nuclear receptor NHR-88 0.001 0.0161 0.0161
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0161 0.0161
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0161 0.0377
Plasmodium falciparum polyadenylate-binding protein, putative 0.0009 0.0126 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0161 0.0161

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 29.0929 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

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.

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