Detailed information for compound 845658

Basic information

Technical information
  • TDR Targets ID: 845658
  • Name: 4-methylthieno[2,3-d]pyrrole-5-carboxylic aci d
  • MW: 181.212 | Formula: C8H7NO2S
  • H donors: 1 H acceptors: 2 LogP: 1.63 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)c1cc2c(n1C)ccs2
  • InChi: 1S/C8H7NO2S/c1-9-5-2-3-12-7(5)4-6(9)8(10)11/h2-4H,1H3,(H,10,11)
  • InChiKey: TZHAUWSWUZWKLK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-methyl-5-thieno[2,3-d]pyrrolecarboxylic acid
  • CC 40901

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
Brugia malayi Calcitonin receptor-like protein seb-1 0.0058 0.0429 0.1323
Loa Loa (eye worm) steroid hormone receptor 0.0023 0.005 0.0155
Schistosoma mansoni RAR-like nuclear receptor 0.0023 0.005 0.0155
Schistosoma mansoni transcription factor LCR-F1 0.0042 0.0254 0.0784
Trichomonas vaginalis thymidine kinase, putative 0.055 0.5714 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0023 0.005 0.005
Echinococcus granulosus geminin 0.0198 0.1933 1
Onchocerca volvulus Protein ultraspiracle homolog 0.0023 0.005 0.5
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0023 0.005 0.0155
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0023 0.005 0.026
Brugia malayi nuclear hormone receptor 0.0023 0.005 0.0155
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0023 0.005 0.0155
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0023 0.005 0.0155
Brugia malayi photoreceptor-specific nuclear receptor 0.0023 0.005 0.0155
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0023 0.005 0.026
Schistosoma mansoni retinoic acid receptor RXR 0.0023 0.005 0.0155
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0042 0.0254 0.1315
Loa Loa (eye worm) hypothetical protein 0.0023 0.005 0.0155
Loa Loa (eye worm) hypothetical protein 0.0058 0.0429 0.1323
Brugia malayi steroid hormone receptor 0.0023 0.005 0.0155
Trichomonas vaginalis thymidine kinase, putative 0.055 0.5714 1
Schistosoma mansoni glutaminase 0.032 0.324 1
Brugia malayi hypothetical protein 0.0042 0.0254 0.0784
Loa Loa (eye worm) hypothetical protein 0.0023 0.005 0.0155
Trypanosoma cruzi thymidine kinase, putative 0.055 0.5714 0.5
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0048 0.0314 0.5
Echinococcus granulosus FTZ F1 alpha 0.0023 0.005 0.026
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0023 0.005 0.005
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0023 0.005 0.0155
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0023 0.005 0.0155
Loa Loa (eye worm) hypothetical protein 0.0023 0.005 0.0155
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0023 0.005 0.005
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0058 0.0429 0.1323
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0023 0.005 0.0155
Leishmania major thymidine kinase, putative 0.055 0.5714 0.5
Brugia malayi Steroid receptor seven-up type 2 0.0023 0.005 0.0155
Schistosoma mansoni hypothetical protein 0.0198 0.1933 0.5966
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0048 0.0314 0.5
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0023 0.005 0.0155
Loa Loa (eye worm) hypothetical protein 0.0023 0.005 0.0155
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0023 0.005 0.0155
Trichomonas vaginalis glutaminase, putative 0.032 0.324 0.5418
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0023 0.005 0.0155
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0023 0.005 0.0155
Echinococcus granulosus histone acetyltransferase KAT2B 0.0048 0.0314 0.1624
Schistosoma mansoni hypothetical protein 0.004 0.023 0.0711
Brugia malayi ecdysteroid receptor 0.0023 0.005 0.0155
Trypanosoma brucei thymidine kinase 0.055 0.5714 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0023 0.005 0.0155
Schistosoma mansoni nuclear hormone receptor 0.0023 0.005 0.0155
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0023 0.005 0.026
Brugia malayi glutaminase DH11.1 0.032 0.324 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.005 0.0155
Schistosoma mansoni steroid hormone receptor ad4bp 0.0023 0.005 0.0155
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0023 0.005 0.0155
Echinococcus granulosus histone acetyltransferase KAT2B 0.0157 0.1495 0.7733
Brugia malayi acetyltransferase, GNAT family protein 0.0162 0.1543 0.4764
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0023 0.005 0.0155
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0023 0.005 0.0155
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0023 0.005 0.0155
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0162 0.1543 0.1543
Schistosoma mansoni coup transcription factor 0.0023 0.005 0.0155
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0023 0.005 0.0155
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0023 0.005 0.0155
Plasmodium falciparum histone acetyltransferase GCN5 0.0044 0.0271 0.5
Schistosoma mansoni hypothetical protein 0.0198 0.1933 0.5966
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0023 0.005 0.0155
Brugia malayi nuclear receptor NHR-88 0.0023 0.005 0.0155
Entamoeba histolytica thymidine kinase, putative 0.055 0.5714 1
Loa Loa (eye worm) hypothetical protein 0.004 0.023 0.0711
Echinococcus multilocularis FTZ F1 alpha 0.0023 0.005 0.005
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0023 0.005 0.005
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0023 0.005 0.0155
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0023 0.005 0.026
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0058 0.0429 0.1323
Giardia lamblia Thymidine kinase 0.055 0.5714 1
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0162 0.1543 0.4764
Mycobacterium ulcerans glutaminase 0.032 0.324 0.5
Echinococcus multilocularis geminin 0.0198 0.1933 0.1933
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0023 0.005 0.005
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0023 0.005 0.5
Echinococcus multilocularis ecdysone induced protein 78C 0.0023 0.005 0.005
Echinococcus granulosus ecdysone induced protein 78C 0.0023 0.005 0.026
Onchocerca volvulus 0.0023 0.005 0.5
Entamoeba histolytica acetyltransferase, GNAT family 0.0044 0.0271 0.0031
Schistosoma mansoni hypothetical protein 0.0042 0.0254 0.0784
Schistosoma mansoni thyroid hormone receptor 0.0023 0.005 0.0155
Loa Loa (eye worm) glutaminase 0.032 0.324 1
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0048 0.0314 0.5
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0023 0.005 0.0155
Onchocerca volvulus Bile acid receptor homolog 0.0023 0.005 0.5
Brugia malayi latrophilin 2 splice variant baaae 0.004 0.023 0.0711
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0023 0.005 0.005
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0023 0.005 0.0155
Loa Loa (eye worm) glutaminase 2 0.032 0.324 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.005 0.0155
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0023 0.005 0.0155
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0023 0.005 0.0155
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0023 0.005 0.0155
Schistosoma mansoni thyroid hormone receptor 0.0023 0.005 0.0155
Loa Loa (eye worm) hypothetical protein 0.0023 0.005 0.0155
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0023 0.005 0.026
Trichomonas vaginalis thymidine kinase, putative 0.055 0.5714 1
Trypanosoma cruzi thymidine kinase, putative 0.055 0.5714 0.5
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0023 0.005 0.026
Loa Loa (eye worm) hypothetical protein 0.0023 0.005 0.0155
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0023 0.005 0.0155
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0023 0.005 0.026
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0023 0.005 0.0155
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0042 0.0254 0.0254
Brugia malayi Nuclear hormone receptor-like 1 0.0023 0.005 0.0155
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0023 0.005 0.005
Loa Loa (eye worm) acetyltransferase 0.0162 0.1543 0.4764

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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