Detailed information for compound 1580677

Basic information

Technical information
  • TDR Targets ID: 1580677
  • Name: 7,8-dimethoxy-1-naphthalen-2-yl-3,5-dihydro-2 ,3-benzodiazepin-4-one
  • MW: 346.379 | Formula: C21H18N2O3
  • H donors: 1 H acceptors: 1 LogP: 3.81 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc2c(cc1OC)CC(=O)NN=C2c1ccc2c(c1)cccc2
  • InChi: 1S/C21H18N2O3/c1-25-18-10-16-11-20(24)22-23-21(17(16)12-19(18)26-2)15-8-7-13-5-3-4-6-14(13)9-15/h3-10,12H,11H2,1-2H3,(H,22,24)
  • InChiKey: JFDMEXAPYNQXFH-UHFFFAOYSA-N  

Network

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Synonyms

  • 7,8-dimethoxy-1-(2-naphthyl)-3,5-dihydro-2,3-benzodiazepin-4-one

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) hypothetical protein 0.005 0.0371 0.0462
Echinococcus multilocularis carnitine O palmitoyltransferase 1, liver 0.0192 0.2513 0.2398
Onchocerca volvulus 0.0035 0.0151 0.5
Trypanosoma cruzi carnitine O-palmitoyltransferase II, putative 0.0035 0.0151 0.0602
Schistosoma mansoni DNA polymerase eta 0.0045 0.0294 0.0163
Trypanosoma brucei carnitine O-palmitoyltransferase, putative 0.0035 0.0151 0.0375
Trypanosoma cruzi carnitine/choline acetyltransferase, putative 0.0035 0.0151 0.0602
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0151 0.0602
Trypanosoma brucei carnitine O-palmitoyltransferase II, putative 0.0035 0.0151 0.0375
Brugia malayi Choline/Carnitine o-acyltransferase family protein 0.0035 0.0151 0.0189
Brugia malayi Choline O-acetyltransferase 0.0035 0.0151 0.0189
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0371 0.0462
Trypanosoma cruzi DNA polymerase eta, putative 0.0045 0.0294 0.1171
Echinococcus granulosus carnitine O palmitoyltransferase 1 liver 0.0192 0.2513 0.2398
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0371 0.0462
Trypanosoma cruzi carnitine/choline acetyltransferase, putative 0.0035 0.0151 0.0602
Brugia malayi Choline/Carnitine o-acyltransferase family protein 0.0035 0.0151 0.0189
Echinococcus multilocularis geminin 0.0169 0.217 0.2049
Trypanosoma cruzi choline/carnitine O-acyltransferase, putative 0.0192 0.2513 1
Trypanosoma cruzi choline/carnitine O-acyltransferase, putative 0.0192 0.2513 1
Trypanosoma cruzi choline/carnitine O-acetyltransferase, putative 0.0035 0.0151 0.0602
Echinococcus multilocularis microtubule associated protein 2 0.069 1 1
Leishmania major DNA polymerase eta, putative 0.0031 0.0094 0.0374
Loa Loa (eye worm) hypothetical protein 0.0558 0.8016 1
Brugia malayi Choline/Carnitine o-acyltransferase family protein 0.0558 0.8016 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0151 0.0189
Echinococcus granulosus dna polymerase eta 0.0045 0.0294 0.0145
Onchocerca volvulus 0.0035 0.0151 0.5
Trypanosoma cruzi choline/carnitine O-acyltransferase, putative 0.0035 0.0151 0.0602
Onchocerca volvulus 0.0035 0.0151 0.5
Trypanosoma cruzi DNA polymerase eta, putative 0.0031 0.0094 0.0374
Onchocerca volvulus 0.0035 0.0151 0.5
Schistosoma mansoni hypothetical protein 0.0293 0.4034 0.3953
Loa Loa (eye worm) choline O-acetyltransferase 0.0035 0.0151 0.0189
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0151 0.0602
Schistosoma mansoni choline o-acyltransferase 0.0035 0.0151 0.0018
Trypanosoma brucei carnitine O-acetyltransferase, putative 0.0035 0.0151 0.0375
Leishmania major carnitine/choline acetyltransferase, putative 0.0035 0.0151 0.0602
Loa Loa (eye worm) choline/Carnitine O-acyltransferase 0.0035 0.0151 0.0189
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0133 0.0166
Schistosoma mansoni hypothetical protein 0.0169 0.217 0.2064
Echinococcus granulosus geminin 0.0169 0.217 0.2049
Leishmania major DNA polymerase eta, putative 0.0045 0.0294 0.1171
Leishmania major carnitine palmitoyltransferase-like protein 0.0035 0.0151 0.0602
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0031 0.0094 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0133 0.0166
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0151 0.0602
Trypanosoma brucei carnitine O-palmitoyltransferase II, putative 0.0035 0.0151 0.0375
Schistosoma mansoni hypothetical protein 0.0169 0.217 0.2064
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0 0.5
Trypanosoma brucei RNA helicase, putative 0.0293 0.4034 1
Brugia malayi Choline O-acetyltransferase 0.0035 0.0151 0.0189
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0 0.5
Trypanosoma cruzi carnitine O-acetyltransferase, putative 0.0035 0.0151 0.0602
Echinococcus multilocularis dna polymerase eta 0.0045 0.0294 0.0145
Loa Loa (eye worm) hypothetical protein 0.0045 0.0294 0.0367
Trypanosoma brucei DNA polymerase eta, putative 0.0045 0.0294 0.0729
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0151 0.0375
Schistosoma mansoni choline o-acyltransferase 0.0035 0.0151 0.0018
Schistosoma mansoni microtubule-associated protein tau 0.069 1 1
Loa Loa (eye worm) carnitine O-palmitoyltransferase I isoform 0.0035 0.0151 0.0189
Leishmania major choline/Carnitine o-acyltransferase-like protein 0.0192 0.2513 1
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0151 0.0602
Brugia malayi ImpB/MucB/SamB family protein 0.0045 0.0294 0.0367
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0151 0.0602
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0371 0.0462
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0 0.5

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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