Detailed information for compound 739650

Basic information

Technical information
  • TDR Targets ID: 739650
  • Name: N-(4-dimethylaminophenyl)-2-[5-(4-methylpheny l)thieno[3,2-e]pyrimidin-4-yl]sulfanylacetami de
  • MW: 434.577 | Formula: C23H22N4OS2
  • H donors: 1 H acceptors: 3 LogP: 5.42 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccc(cc1)N(C)C)CSc1ncnc2c1c(cs2)c1ccc(cc1)C
  • InChi: 1S/C23H22N4OS2/c1-15-4-6-16(7-5-15)19-12-29-22-21(19)23(25-14-24-22)30-13-20(28)26-17-8-10-18(11-9-17)27(2)3/h4-12,14H,13H2,1-3H3,(H,26,28)
  • InChiKey: ZIKFSJUCVAEORL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(4-dimethylaminophenyl)-2-[5-(4-methylphenyl)thieno[3,2-e]pyrimidin-4-yl]sulfanyl-acetamide
  • N-(4-dimethylaminophenyl)-2-[[5-(4-methylphenyl)-4-thieno[3,2-e]pyrimidinyl]thio]acetamide
  • N-(4-dimethylaminophenyl)-2-[[5-(4-methylphenyl)thieno[3,2-e]pyrimidin-4-yl]thio]acetamide
  • N-(4-dimethylaminophenyl)-2-[5-(4-methylphenyl)thieno[3,2-e]pyrimidin-4-yl]sulfanyl-ethanamide
  • ZINC02865607
  • ST5020039
  • CBKinase1_021120
  • CBKinase1_008720
  • BAS 04462051

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 cruzi poly(ADP-ribose) glycohydrolase, putative 0.0341 1 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0101 0.2242 0.2242
Entamoeba histolytica poly(ADP-ribose) glycohydrolase, putative 0.0152 0.3879 0.1803
Schistosoma mansoni hypothetical protein 0.0063 0.1012 0.1012
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0442 0.0442
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0442 0.0442
Brugia malayi Calcitonin receptor-like protein seb-1 0.0101 0.2242 0.2242
Echinococcus multilocularis geminin 0.017 0.4443 0.4443
Schistosoma mansoni hypothetical protein 0.017 0.4443 0.4443
Loa Loa (eye worm) DnaJ domain-containing protein 0.0063 0.1012 0.1012
Trichomonas vaginalis protein kinase inhibitor, putative 0.0063 0.1012 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0442 0.0442
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0442 0.0442
Trypanosoma cruzi PAB1-binding protein , putative 0.0051 0.0604 0.05
Brugia malayi hypothetical protein 0.011 0.2533 0.2533
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0442 0.0442
Brugia malayi DnaJ domain containing protein 0.0063 0.1012 0.1012
Plasmodium vivax ataxin-2 like protein, putative 0.0051 0.0604 1
Loa Loa (eye worm) Poly(ADP-ribose) glycohydrolase 0.0341 1 1
Brugia malayi latrophilin 2 splice variant baaae 0.0069 0.1204 0.1204
Brugia malayi Augmenter of liver regeneration 0.0036 0.011 0.011
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.011 0.2533 0.2533
Brugia malayi hypothetical protein 0.0051 0.0604 0.0604
Trypanosoma cruzi PAB1-binding protein , putative 0.0051 0.0604 0.05
Entamoeba histolytica poly(ADP-ribose) glycohydrolase, putative 0.0341 1 1
Loa Loa (eye worm) hypothetical protein 0.0051 0.0604 0.0604
Schistosoma mansoni hypothetical protein 0.011 0.2533 0.2533
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0442 0.0442
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0442 0.0442
Schistosoma mansoni hypothetical protein 0.017 0.4443 0.4443
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0101 0.2242 0.2242
Trypanosoma cruzi poly(ADP-ribose) glycohydrolase, putative 0.0341 1 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0051 0.0604 1
Echinococcus multilocularis dnaJ subfamily C 6 0.0063 0.1012 0.1012
Brugia malayi hypothetical protein 0.0033 0.0022 0.0022
Echinococcus granulosus FAD linked sulfhydryl oxidase ALR 0.0036 0.011 0.011
Schistosoma mansoni transcription factor LCR-F1 0.011 0.2533 0.2533
Toxoplasma gondii LsmAD domain-containing protein 0.0051 0.0604 0.05
Loa Loa (eye worm) hypothetical protein 0.0069 0.1204 0.1204
Trypanosoma brucei PAB1-binding protein , putative 0.0051 0.0604 0.05
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.011 0.2533 0.2533
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0442 0.0442
Loa Loa (eye worm) hypothetical protein 0.0101 0.2242 0.2242
Echinococcus granulosus dnaJ subfamily C 6 0.0063 0.1012 0.1012
Toxoplasma gondii poly(ADP-ribose) glycohydrolase 0.0341 1 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0051 0.0604 1
Echinococcus granulosus polyADP ribose glycohydrolase 0.0341 1 1
Entamoeba histolytica hypothetical protein 0.0341 1 1
Schistosoma mansoni poly(ADP-ribose) glycohydrolase 0.0341 1 1
Loa Loa (eye worm) hepatopoietin HPO2 0.0036 0.011 0.011
Trypanosoma brucei poly(ADP-ribose) glycohydrolase, putative 0.0341 1 1
Toxoplasma gondii poly(ADP-ribose) glycohydrolase 0.0152 0.3879 0.3811
Echinococcus multilocularis poly(ADP ribose) glycohydrolase 0.0341 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0442 0.0442
Echinococcus granulosus geminin 0.017 0.4443 0.4443
Schistosoma mansoni hypothetical protein 0.0069 0.1204 0.1204
Leishmania major hypothetical protein, conserved 0.0051 0.0604 1
Echinococcus multilocularis FAD linked sulfhydryl oxidase ALR 0.0036 0.011 0.011
Entamoeba histolytica hypothetical protein 0.0152 0.3879 0.1803

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.

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