Detailed information for compound 663533

Basic information

Technical information
  • TDR Targets ID: 663533
  • Name: 2-[[5-(2-methyl-4-nitrophenyl)furan-2-yl]meth ylidene]indene-1,3-dione
  • MW: 359.332 | Formula: C21H13NO5
  • H donors: 0 H acceptors: 4 LogP: 4.46 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1cc(ccc1c1ccc(o1)C=C1C(=O)c2c(C1=O)cccc2)[N+](=O)[O-]
  • InChi: 1S/C21H13NO5/c1-12-10-13(22(25)26)6-8-15(12)19-9-7-14(27-19)11-18-20(23)16-4-2-3-5-17(16)21(18)24/h2-11H,1H3
  • InChiKey: HQKLNEMGKMIGNP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[[5-(2-methyl-4-nitro-phenyl)-2-furyl]methylene]indane-1,3-dione
  • 2-[[5-(2-methyl-4-nitrophenyl)-2-furyl]methylene]indane-1,3-dione
  • 2-[[5-(2-methyl-4-nitro-phenyl)-2-furyl]methylene]indane-1,3-quinone
  • 2-[[5-(2-methyl-4-nitro-phenyl)furan-2-yl]methylidene]indene-1,3-dione
  • ZINC00636703
  • AO-081/40681137
  • STK161273

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
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.4645 0.4645
Brugia malayi MH2 domain containing protein 0.013 0.6975 0.7521
Loa Loa (eye worm) RNA binding protein 0.0066 0.2922 0.315
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.1435 0.1435
Brugia malayi RNA recognition motif domain containing protein 0.0066 0.2922 0.315
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0 0.5
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0 0.5
Brugia malayi Latrophilin receptor protein 2 0.0053 0.2043 0.2203
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0166 0.9274 1
Echinococcus granulosus tar DNA binding protein 0.0066 0.2922 0.2922
Schistosoma mansoni hypothetical protein 0.0053 0.2043 0.2043
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0066 0.2922 0.315
Schistosoma mansoni hypothetical protein 0.0177 1 1
Schistosoma mansoni hypothetical protein 0.0113 0.5927 0.5927
Schistosoma mansoni tar DNA-binding protein 0.0066 0.2922 0.2922
Echinococcus multilocularis tar DNA binding protein 0.0066 0.2922 0.2922
Brugia malayi Calcitonin receptor-like protein seb-1 0.0166 0.9274 1
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0 0.5
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0053 0.2043 0.2043
Trichomonas vaginalis ap endonuclease, putative 0.002 0 0.5
Brugia malayi TAR-binding protein 0.0066 0.2922 0.315
Loa Loa (eye worm) hypothetical protein 0.0166 0.9274 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0053 0.2043 0.2043
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.4645 0.4645
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0053 0.2043 0.2203
Entamoeba histolytica hypothetical protein 0.0043 0.1435 1
Schistosoma mansoni hypothetical protein 0.0053 0.2043 0.2043
Toxoplasma gondii exonuclease III APE 0.002 0 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.4645 0.4645
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.1435 0.1435
Schistosoma mansoni hypothetical protein 0.0043 0.1435 0.1435
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.002 0 0.5
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0 0.5
Entamoeba histolytica hypothetical protein 0.0043 0.1435 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0166 0.9274 1
Echinococcus multilocularis geminin 0.0177 1 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0093 0.4645 0.5008
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.1435 0.1435
Echinococcus granulosus GPCR family 2 0.0053 0.2043 0.2043
Entamoeba histolytica hypothetical protein 0.0043 0.1435 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0 0.5
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0053 0.2043 0.2043
Schistosoma mansoni tar DNA-binding protein 0.0066 0.2922 0.2922
Schistosoma mansoni tar DNA-binding protein 0.0066 0.2922 0.2922
Loa Loa (eye worm) hypothetical protein 0.0113 0.5927 0.6391
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0053 0.2043 0.2043
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0 0.5
Brugia malayi hypothetical protein 0.0043 0.1435 0.1547
Loa Loa (eye worm) latrophilin receptor protein 2 0.0053 0.2043 0.2203
Loa Loa (eye worm) transcription factor SMAD2 0.013 0.6975 0.7521
Schistosoma mansoni hypothetical protein 0.0053 0.2043 0.2043
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.4645 0.4645
Schistosoma mansoni hypothetical protein 0.0053 0.2043 0.2043
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.4645 0.4645
Brugia malayi latrophilin 2 splice variant baaae 0.0113 0.5927 0.6391
Loa Loa (eye worm) TAR-binding protein 0.0066 0.2922 0.315
Schistosoma mansoni hypothetical protein 0.0177 1 1
Schistosoma mansoni tar DNA-binding protein 0.0066 0.2922 0.2922
Loa Loa (eye worm) hypothetical protein 0.0053 0.2043 0.2203
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0 0.5
Trichomonas vaginalis ap endonuclease, putative 0.002 0 0.5
Loa Loa (eye worm) MH2 domain-containing protein 0.013 0.6975 0.7521
Echinococcus multilocularis GPCR, family 2 0.0053 0.2043 0.2043
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0 0.5
Entamoeba histolytica hypothetical protein 0.0043 0.1435 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.4645 0.4645
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0093 0.4645 0.5008
Brugia malayi RNA binding protein 0.0066 0.2922 0.315
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0 0.5
Schistosoma mansoni tar DNA-binding protein 0.0066 0.2922 0.2922
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.4645 0.4645

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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