Detailed information for compound 824851

Basic information

Technical information
  • TDR Targets ID: 824851
  • Name: 3-(benzoyl)-6-fluoro-1-[(3-methoxyphenyl)meth yl]quinolin-4-one
  • MW: 387.403 | Formula: C24H18FNO3
  • H donors: 0 H acceptors: 2 LogP: 4.81 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cccc(c1)Cn1cc(C(=O)c2ccccc2)c(=O)c2c1ccc(c2)F
  • InChi: 1S/C24H18FNO3/c1-29-19-9-5-6-16(12-19)14-26-15-21(23(27)17-7-3-2-4-8-17)24(28)20-13-18(25)10-11-22(20)26/h2-13,15H,14H2,1H3
  • InChiKey: NTEASSKNLZPZEJ-UHFFFAOYSA-N  

Network

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Synonyms

  • 6-fluoro-1-[(3-methoxyphenyl)methyl]-3-(oxo-phenylmethyl)-4-quinolinone
  • 3-(benzoyl)-6-fluoro-1-(3-methoxybenzyl)-4-quinolone
  • 6-fluoro-1-[(3-methoxyphenyl)methyl]-3-phenylcarbonyl-quinolin-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
Mycobacterium ulcerans proteasome PrcB 0.0224 1 0.5
Echinococcus granulosus proteasome prosome macropain subunit beta 0.0174 0.6916 0.6916
Trypanosoma cruzi proteasome subunit beta type-5, putative 0.0224 1 1
Trypanosoma cruzi proteasome subunit beta type-5, putative 0.0224 1 1
Mycobacterium leprae proteasome (beta subunit) PrcB 0.0224 1 0.5
Leishmania major proteasome beta 5 subunit, putative 0.0224 1 1
Onchocerca volvulus 0.0062 0 0.5
Onchocerca volvulus 0.0062 0 0.5
Schistosoma mansoni proteasome subunit beta 1 (T01 family) 0.0174 0.6916 0.6916
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0224 1 1
Schistosoma mansoni proteasome catalytic subunit 3 (T01 family) 0.0224 1 1
Onchocerca volvulus Neuropeptide F receptor homolog 0.0062 0 0.5
Echinococcus multilocularis proteasome (prosome, macropain) 0.0224 1 1
Plasmodium vivax proteasome subunit beta type-1, putative 0.0174 0.6916 0.5699
Onchocerca volvulus 0.0062 0 0.5
Giardia lamblia Proteasome subunit beta type 1 0.0174 0.6916 0.5699
Plasmodium falciparum proteasome subunit beta type-5 0.0224 1 1
Plasmodium vivax proteasome subunit beta type-5, putative 0.0224 1 1
Loa Loa (eye worm) proteasome subunit beta type 1 0.0174 0.6916 0.6916
Leishmania major proteasome beta 6 subunit, putative,20S proteasome beta 6 subunit, putative 0.0174 0.6916 0.5699
Onchocerca volvulus 0.0062 0 0.5
Entamoeba histolytica proteasome subunit beta type 5 precursor, putative 0.0224 1 1
Plasmodium falciparum proteasome subunit beta type-1, putative 0.0174 0.6916 0.5699
Onchocerca volvulus 0.0062 0 0.5
Loa Loa (eye worm) proteasome subunit beta type 2 0.0108 0.283 0.283
Onchocerca volvulus 0.0062 0 0.5
Entamoeba histolytica proteasome subunit beta type 1, putative 0.0174 0.6916 0.5699
Brugia malayi proteasome subunit beta type 2 0.0108 0.283 0.283
Echinococcus granulosus proteasome prosome macropain subunit beta 0.0108 0.283 0.283
Onchocerca volvulus 0.0062 0 0.5
Loa Loa (eye worm) proteasome A-type and B-type family protein 0.0224 1 1
Giardia lamblia Proteasome subunit beta type 5 precursor 0.0224 1 1
Trypanosoma cruzi proteasome beta 6 subunit, putative 0.0174 0.6916 0.5699
Onchocerca volvulus 0.0062 0 0.5
Toxoplasma gondii proteasome subunit beta type, putative 0.0224 1 1
Toxoplasma gondii proteasome subunit beta type 1, putative 0.0174 0.6916 0.5699
Trypanosoma brucei proteasome subunit beta type-5, putative 0.0224 1 1
Onchocerca volvulus 0.0062 0 0.5
Schistosoma mansoni proteasome subunit beta 2 (T01 family) 0.0108 0.283 0.283
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0174 0.6916 0.5699
Onchocerca volvulus 0.0062 0 0.5
Onchocerca volvulus 0.0062 0 0.5
Onchocerca volvulus 0.0062 0 0.5
Onchocerca volvulus 0.0062 0 0.5
Onchocerca volvulus 0.0062 0 0.5
Echinococcus multilocularis proteasome (prosome, macropain) subunit, beta 0.0108 0.283 0.283
Onchocerca volvulus 0.0062 0 0.5
Trypanosoma brucei proteasome beta 6 subunit 0.0174 0.6916 0.5699
Trypanosoma cruzi proteasome beta 6 subunit, putative 0.0174 0.6916 0.5699
Onchocerca volvulus 0.0062 0 0.5
Schistosoma mansoni proteasome subunit beta 2 (T01 family) 0.0108 0.283 0.283
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0062 0 0.5
Echinococcus multilocularis proteasome (prosome, macropain) subunit, beta 0.0174 0.6916 0.6916
Mycobacterium tuberculosis Proteasome beta subunit PrcB; assembles with alpha subunit PrcA. 0.0224 1 0.5
Onchocerca volvulus 0.0062 0 0.5
Echinococcus granulosus proteasome prosome macropain 0.0224 1 1
Brugia malayi proteasome subunit beta type 1 0.0174 0.6916 0.6916

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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