Detailed information for compound 690812

Basic information

Technical information
  • TDR Targets ID: 690812
  • Name: 2-chloro-N-[(4-oxo-3H-phthalazin-1-yl)methyl] benzamide
  • MW: 313.738 | Formula: C16H12ClN3O2
  • H donors: 2 H acceptors: 4 LogP: 2.51 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1ccccc1Cl)NCc1nnc(c2c1cccc2)O
  • InChi: 1S/C16H12ClN3O2/c17-13-8-4-3-7-12(13)15(21)18-9-14-10-5-1-2-6-11(10)16(22)20-19-14/h1-8H,9H2,(H,18,21)(H,20,22)
  • InChiKey: NTLZFGUZGRJMKX-UHFFFAOYSA-N  

Network

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Synonyms

  • 2-chloro-N-[(4-keto-3H-phthalazin-1-yl)methyl]benzamide
  • ZINC04317469

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
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 1 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0431 0.0431
Loa Loa (eye worm) hypothetical protein 0.001 0.0431 0.0431
Brugia malayi nuclear hormone receptor 0.001 0.0431 0.0431
Brugia malayi steroid hormone receptor 0.001 0.0431 0.0431
Brugia malayi ecdysteroid receptor 0.001 0.0431 0.0431
Entamoeba histolytica hypothetical protein 0.0035 0.2676 0.5
Schistosoma mansoni coup transcription factor 0.001 0.0431 0.1612
Schistosoma mansoni smad1 5 8 and 0.0008 0.0231 0.0864
Brugia malayi Smad1 0.0008 0.0231 0.0231
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0431 0.1612
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0431 0.0431
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0431 0.1612
Brugia malayi hypothetical protein 0.0035 0.2676 0.2676
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0431 0.0431
Entamoeba histolytica hypothetical protein 0.0035 0.2676 0.5
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0431 0.1612
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0431 0.1612
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0431 0.1612
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0431 0.1612
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0431 0.1612
Schistosoma mansoni Smad4 0.0008 0.0231 0.0864
Brugia malayi nuclear receptor NHR-88 0.001 0.0431 0.0431
Echinococcus multilocularis mothers against decapentaplegic 5 0.0008 0.0231 0.0864
Loa Loa (eye worm) hypothetical protein 0.001 0.0431 0.0431
Schistosoma mansoni smad1 5 8 and 0.0008 0.0231 0.0864
Brugia malayi MH2 domain containing protein 0.0008 0.0231 0.0231
Loa Loa (eye worm) hypothetical protein 0.001 0.0431 0.0431
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0431 0.1612
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0431 0.1612
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0431 0.0431
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0431 0.0431
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0431 0.0431
Loa Loa (eye worm) hypothetical protein 0.001 0.0431 0.0431
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0431 0.1612
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0431 0.1612
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0431 0.0431
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0431 0.0431
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0431 0.1612
Entamoeba histolytica hypothetical protein 0.0035 0.2676 0.5
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0431 0.5
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0431 0.1612
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0431 0.1612
Loa Loa (eye worm) hypothetical protein 0.001 0.0431 0.0431
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0431 0.0431
Echinococcus granulosus smad 0.0008 0.0231 0.0864
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0431 0.1612
Loa Loa (eye worm) Smad1 0.0008 0.0231 0.0231
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0431 0.0431
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0431 0.1612
Schistosoma mansoni hypothetical protein 0.0035 0.2676 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.2676 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0431 0.1612
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0431 0.0431
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0431 0.0431
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0431 0.0431
Echinococcus granulosus TGF beta signal transducer SmadC 0.0008 0.0231 0.0864
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0431 0.1612
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0431 0.1612
Loa Loa (eye worm) hypothetical protein 0.001 0.0431 0.0431
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0231 0.0864
Onchocerca volvulus 0.001 0.0431 0.5
Entamoeba histolytica hypothetical protein 0.0035 0.2676 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0431 0.0431
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.2676 1
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0231 0.0231
Loa Loa (eye worm) hypothetical protein 0.001 0.0431 0.0431
Schistosoma mansoni thyroid hormone receptor 0.001 0.0431 0.1612
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0431 0.0431
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0431 0.1612
Brugia malayi MH1 domain containing protein 0.0008 0.0231 0.0231
Schistosoma mansoni smad1 5 8 and 0.0008 0.0231 0.0864
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0431 0.0431
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0431 0.0431
Loa Loa (eye worm) hypothetical protein 0.001 0.0431 0.0431
Echinococcus multilocularis Smad4 0.0008 0.0231 0.0864
Brugia malayi MH2 domain containing protein 0.0008 0.0231 0.0231
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0431 0.0431
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0431 0.0431
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0431 0.0431
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0431 0.1612
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.2676 1
Echinococcus multilocularis smad 0.0008 0.0231 0.0864
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0431 0.0431
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0231 0.0231
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0431 0.0431
Schistosoma mansoni smad 0.0008 0.0231 0.0864
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0431 0.1612
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0431 0.1612
Echinococcus granulosus mothers against decapentaplegic 5 0.0008 0.0231 0.0864
Echinococcus granulosus FTZ F1 alpha 0.001 0.0431 0.1612
Schistosoma mansoni thyroid hormone receptor 0.001 0.0431 0.1612
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0008 0.0231 0.0864
Echinococcus granulosus Smad4 0.0008 0.0231 0.0864
Loa Loa (eye worm) transcription factor SMAD2 0.0116 1 1
Schistosoma mansoni nuclear hormone receptor 0.001 0.0431 0.1612
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0431 0.1612
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0431 0.0431
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0431 0.1612
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0431 0.1612
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0431 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0431 0.0431
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0431 0.5
Brugia malayi MH1 domain containing protein 0.0008 0.0231 0.0231

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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