Detailed information for compound 825207

Basic information

Technical information
  • TDR Targets ID: 825207
  • Name: 2-[6-fluoro-3-(4-methoxyphenyl)sulfonyl-4-oxo quinolin-1-yl]-N-(3-methylphenyl)acetamide
  • MW: 480.508 | Formula: C25H21FN2O5S
  • H donors: 1 H acceptors: 4 LogP: 4.04 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)S(=O)(=O)c1cn(CC(=O)Nc2cccc(c2)C)c2c(c1=O)cc(cc2)F
  • InChi: 1S/C25H21FN2O5S/c1-16-4-3-5-18(12-16)27-24(29)15-28-14-23(25(30)21-13-17(26)6-11-22(21)28)34(31,32)20-9-7-19(33-2)8-10-20/h3-14H,15H2,1-2H3,(H,27,29)
  • InChiKey: CVYZCPIFTDIIBL-UHFFFAOYSA-N  

Network

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Synonyms

  • 2-[6-fluoro-3-(4-methoxyphenyl)sulfonyl-4-oxo-1-quinolyl]-N-(3-methylphenyl)acetamide
  • 2-[6-fluoro-4-keto-3-(4-methoxyphenyl)sulfonyl-1-quinolyl]-N-(3-methylphenyl)acetamide
  • 2-[6-fluoro-3-(4-methoxyphenyl)sulfonyl-4-oxo-quinolin-1-yl]-N-(3-methylphenyl)ethanamide

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
Onchocerca volvulus 0.0284 0.1283 0.1449
Brugia malayi SEA domain containing protein 0.0284 0.1283 0.1449
Loa Loa (eye worm) hypothetical protein 0.0378 0.2484 0.2804
Echinococcus granulosus tissue type plasminogen activator 0.0378 0.2484 1
Onchocerca volvulus 0.0284 0.1283 0.1449
Brugia malayi Muscle positioning protein 4 0.0332 0.1896 0.214
Loa Loa (eye worm) DOMON domain-containing protein 0.0284 0.1283 0.1449
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0224 0.0526 0.0526
Loa Loa (eye worm) hypothetical protein 0.0284 0.1283 0.1449
Brugia malayi Kringle domain containing protein 0.0378 0.2484 0.2804
Onchocerca volvulus 0.0378 0.2484 0.2804
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0378 0.2484 0.5
Onchocerca volvulus 0.0694 0.6522 0.7361
Brugia malayi Trypsin family protein 0.0877 0.886 1
Onchocerca volvulus 0.0877 0.886 1
Schistosoma mansoni hypothetical protein 0.0378 0.2484 0.2484
Plasmodium falciparum cysteine repeat modular protein 1 0.0378 0.2484 0.5
Toxoplasma gondii PAN domain-containing protein 0.089 0.9029 1
Echinococcus multilocularis tissue type plasminogen activator 0.0378 0.2484 1
Loa Loa (eye worm) hypothetical protein 0.0332 0.1896 0.214
Toxoplasma gondii PAN domain-containing protein 0.089 0.9029 1
Trypanosoma cruzi hypothetical protein, conserved 0.0378 0.2484 0.5
Loa Loa (eye worm) hypothetical protein 0.0877 0.886 1
Loa Loa (eye worm) TK/ROR protein kinase 0.0378 0.2484 0.2804
Onchocerca volvulus 0.0332 0.1896 0.214
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0221 0.048 0.048
Mycobacterium ulcerans hypothetical protein 0.0183 0 0.5
Brugia malayi Protein kinase domain containing protein 0.0378 0.2484 0.2804
Loa Loa (eye worm) hypothetical protein 0.0877 0.886 1
Onchocerca volvulus 0.0284 0.1283 0.1449
Leishmania major hypothetical protein, conserved 0.0378 0.2484 0.5
Onchocerca volvulus 0.0284 0.1283 0.1449
Schistosoma mansoni hypothetical protein 0.0284 0.1283 0.1283
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0877 0.886 0.886

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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