Detailed information for compound 630736

Basic information

Technical information
  • TDR Targets ID: 630736
  • Name: (4Z)-1-phenyl-4-[(2-propoxyphenyl)methylidene ]pyrazolidine-3,5-dione
  • MW: 322.358 | Formula: C19H18N2O3
  • H donors: 1 H acceptors: 2 LogP: 3.69 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCOc1ccccc1/C=C\1/C(=O)NN(C1=O)c1ccccc1
  • InChi: 1S/C19H18N2O3/c1-2-12-24-17-11-7-6-8-14(17)13-16-18(22)20-21(19(16)23)15-9-4-3-5-10-15/h3-11,13H,2,12H2,1H3,(H,20,22)/b16-13-
  • InChiKey: VLYWRCZMSZDECH-SSZFMOIBSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (4Z)-1-phenyl-4-[(2-propoxyphenyl)methylene]pyrazolidine-3,5-dione
  • (4Z)-1-phenyl-4-(2-propoxybenzylidene)pyrazolidine-3,5-quinone
  • ZINC02900155
  • BIM-0023320.P001

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 multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0287 0.0287
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.01 0.1296 0.1296
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.01 0.1296 0.1296
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.008 0.091 0.1685
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0039 0.0103 0.0103
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0062 0.0062
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0106 0.1402 0.2597
Echinococcus granulosus SAM and MBT domain containing protein 0.0047 0.0257 0.0257
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0051 0.0333 0.0358
Loa Loa (eye worm) transcription factor SMAD2 0.0237 0.3951 0.7319
Loa Loa (eye worm) hypothetical protein 0.0039 0.0103 0.0191
Loa Loa (eye worm) MBCTL1 0.0053 0.0382 0.0708
Schistosoma mansoni lamin 0.008 0.091 0.091
Schistosoma mansoni lamin 0.008 0.091 0.091
Loa Loa (eye worm) hypothetical protein 0.0037 0.0075 0.0138
Schistosoma mansoni hypothetical protein 0.0072 0.0753 0.0753
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0287 0.0287
Loa Loa (eye worm) hypothetical protein 0.0067 0.0648 0.1201
Echinococcus granulosus intermediate filament protein 0.008 0.091 0.091
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0053 0.0382 0.0967
Mycobacterium tuberculosis Conserved hypothetical protein 0.0156 0.237 0.5
Mycobacterium ulcerans hypothetical protein 0.0156 0.237 0.5
Entamoeba histolytica hypothetical protein 0.0037 0.0062 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0287 0.0287
Onchocerca volvulus 0.008 0.091 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0287 0.0287
Schistosoma mansoni twik family of potassium channels-related 0.0189 0.3008 0.3008
Loa Loa (eye worm) hypothetical protein 0.0053 0.0382 0.0708
Echinococcus multilocularis snurportin 1 0.0312 0.5399 0.5399
Echinococcus multilocularis Two pore potassium channel protein sup 9 0.0189 0.3008 0.3008
Brugia malayi MH2 domain containing protein 0.0237 0.3951 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0287 0.0287
Echinococcus multilocularis Glycoside hydrolase, family 27 0.01 0.1296 0.1296
Brugia malayi Intermediate filament tail domain containing protein 0.008 0.091 0.2302
Echinococcus granulosus lamin 0.008 0.091 0.091
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.0257 0.0257
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.0287 0.0725
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0062 0.0062
Echinococcus multilocularis polycomb protein SCMH1 0.0047 0.0257 0.0257
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 38. C. elegans sup-9 ortholog 0.0189 0.3008 0.7611
Schistosoma mansoni hypothetical protein 0.0312 0.5399 0.5399
Echinococcus granulosus histone acetyltransferase MYST2 0.0053 0.0382 0.0382
Echinococcus multilocularis lamin 0.008 0.091 0.091
Loa Loa (eye worm) hypothetical protein 0.0106 0.1402 0.2597
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0312 0.5399 1
Brugia malayi cytoplasmic intermediate filament protein 0.0043 0.0186 0.0471
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0062 0.0062
Echinococcus granulosus lamin dm0 0.008 0.091 0.091
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0053 0.0382 0.0382
Echinococcus granulosus polycomb protein SCMH1 0.0047 0.0257 0.0257
Loa Loa (eye worm) hypothetical protein 0.0037 0.0075 0.0138
Schistosoma mansoni hypothetical protein 0.0549 1 1
Brugia malayi intermediate filament protein 0.008 0.091 0.2302
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0184 0.2921 0.2921
Echinococcus granulosus snurportin 1 0.0312 0.5399 0.5399
Toxoplasma gondii melibiase subfamily protein 0.01 0.1296 1
Echinococcus multilocularis SAM and MBT domain containing protein 0.0047 0.0257 0.0257
Schistosoma mansoni intermediate filament proteins 0.008 0.091 0.091
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0067 0.0648 0.5
Loa Loa (eye worm) MH2 domain-containing protein 0.0237 0.3951 0.7319
Echinococcus multilocularis lamin dm0 0.008 0.091 0.091
Brugia malayi RNA, U transporter 1 0.0083 0.0962 0.2435
Loa Loa (eye worm) mbt repeat family protein 0.0047 0.0257 0.0476
Brugia malayi latrophilin 2 splice variant baaae 0.0072 0.0753 0.1906
Echinococcus multilocularis histone acetyltransferase MYST2 0.0053 0.0382 0.0382
Brugia malayi hypothetical protein 0.0037 0.0062 0.0158
Onchocerca volvulus 0.008 0.091 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0106 0.1402 0.3549
Brugia malayi mbt repeat family protein 0.0047 0.0257 0.065
Loa Loa (eye worm) hypothetical protein 0.0177 0.2787 0.5163
Loa Loa (eye worm) hypothetical protein 0.0189 0.3008 0.5571
Schistosoma mansoni myelin transcription factor 1 myt1 0.0053 0.0382 0.0382
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.0287 0.0531
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0067 0.0648 0.0648
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0287 0.0287
Loa Loa (eye worm) hypothetical protein 0.0072 0.0753 0.1395
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.014 0.2064 0.3871
Loa Loa (eye worm) hypothetical protein 0.0189 0.3008 0.5571
Loa Loa (eye worm) hypothetical protein 0.008 0.091 0.1685
Entamoeba histolytica hypothetical protein 0.0037 0.0062 0.5
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0043 0.0186 0.0344
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.01 0.1296 0.1296
Entamoeba histolytica hypothetical protein 0.0037 0.0062 0.5
Entamoeba histolytica hypothetical protein 0.0037 0.0062 0.5
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0053 0.0382 0.0382
Loa Loa (eye worm) hypothetical protein 0.0047 0.0257 0.0476
Echinococcus multilocularis musashi 0.008 0.091 0.091
Brugia malayi mbt repeat family protein 0.0047 0.0257 0.065
Schistosoma mansoni hypothetical protein 0.0549 1 1
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0296 0.5083 1
Echinococcus granulosus Two pore potassium channel protein sup 9 0.0189 0.3008 0.3008
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0296 0.5083 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0287 0.0287
Leishmania major mitochondrial DNA polymerase beta 0.0296 0.5083 1
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0047 0.0257 0.0257
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0106 0.1402 0.3549
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.014 0.2064 0.3871
Loa Loa (eye worm) intermediate filament protein 0.008 0.091 0.1685
Echinococcus multilocularis geminin 0.0549 1 1
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.01 0.1296 0.1296
Brugia malayi Melibiase family protein 0.0067 0.0648 0.164
Loa Loa (eye worm) hypothetical protein 0.0079 0.0881 0.1632
Schistosoma mansoni hypothetical protein 0.0284 0.4858 0.4858
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0039 0.0103 0.0103
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.01 0.1296 0.1296
Schistosoma mansoni hypothetical protein 0.0037 0.0062 0.0062
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.01 0.1296 0.1296
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0067 0.0648 0.0648
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.0257 0.0257
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0296 0.5083 1
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0184 0.2921 0.2921

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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