Detailed information for compound 824564

Basic information

Technical information
  • TDR Targets ID: 824564
  • Name: N-(3-chlorophenyl)-2-[6-ethoxy-3-(4-fluoroben zoyl)-4-oxoquinolin-1-yl]acetamide
  • MW: 478.899 | Formula: C26H20ClFN2O4
  • H donors: 1 H acceptors: 3 LogP: 5.22 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1ccc2c(c1)c(=O)c(cn2CC(=O)Nc1cccc(c1)Cl)C(=O)c1ccc(cc1)F
  • InChi: 1S/C26H20ClFN2O4/c1-2-34-20-10-11-23-21(13-20)26(33)22(25(32)16-6-8-18(28)9-7-16)14-30(23)15-24(31)29-19-5-3-4-17(27)12-19/h3-14H,2,15H2,1H3,(H,29,31)
  • InChiKey: VPJZCYQYUCYRSS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(3-chlorophenyl)-2-[6-ethoxy-3-(4-fluorobenzoyl)-4-oxo-1-quinolyl]acetamide
  • N-(3-chlorophenyl)-2-[6-ethoxy-3-[(4-fluorophenyl)-oxomethyl]-4-oxo-1-quinolyl]acetamide
  • N-(3-chlorophenyl)-2-[6-ethoxy-3-(4-fluorobenzoyl)-4-keto-1-quinolyl]acetamide
  • N-(3-chlorophenyl)-2-[6-ethoxy-3-(4-fluorophenyl)carbonyl-4-oxo-quinolin-1-yl]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
Brugia malayi TAR-binding protein 0.0061 0.2068 0.2375
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0019 0.005 0.0059
Brugia malayi PHD-finger family protein 0.0053 0.1704 0.1957
Schistosoma mansoni tar DNA-binding protein 0.0061 0.2068 0.2444
Schistosoma mansoni enhancer of polycomb 0.0033 0.0719 0.085
Toxoplasma gondii PHD-finger domain-containing protein 0.0053 0.1704 1
Brugia malayi Pre-SET motif family protein 0.0029 0.0537 0.0617
Echinococcus granulosus tar DNA binding protein 0.0061 0.2068 0.178
Echinococcus granulosus enhancer of polycomb 0.0033 0.0719 0.0261
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.0537 0.0057
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.0537 0.3153
Brugia malayi jmjC domain containing protein 0.0036 0.0877 0.1007
Echinococcus granulosus PHD finger protein rhinoceros 0.0053 0.1704 0.137
Schistosoma mansoni tar DNA-binding protein 0.0061 0.2068 0.2444
Schistosoma mansoni tar DNA-binding protein 0.0061 0.2068 0.2444
Onchocerca volvulus Alhambra homolog 0.0053 0.1704 0.1233
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0537 0.0635
Loa Loa (eye worm) hypothetical protein 0.0029 0.0537 0.0618
Schistosoma mansoni tar DNA-binding protein 0.0061 0.2068 0.2444
Echinococcus multilocularis PHD finger protein rhinoceros 0.0053 0.1704 0.1321
Schistosoma mansoni hypothetical protein 0.0053 0.1704 0.2014
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0196 0.8461 1
Loa Loa (eye worm) TAR-binding protein 0.0061 0.2068 0.2381
Brugia malayi F/Y-rich N-terminus family protein 0.0019 0.005 0.0058
Echinococcus granulosus enhancer of polycomb 0.0033 0.0719 0.0261
Toxoplasma gondii PHD-finger domain-containing protein 0.0053 0.1704 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0537 0.0635
Schistosoma mansoni tar DNA-binding protein 0.0061 0.2068 0.2444
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0061 0.2068 0.2381
Brugia malayi RNA recognition motif domain containing protein 0.0061 0.2068 0.2375
Loa Loa (eye worm) hypothetical protein 0.011 0.4384 0.5047
Schistosoma mansoni phd finger protein 0.0019 0.008 0.0095
Echinococcus granulosus peregrin 0.0215 0.9368 1
Brugia malayi Pre-SET motif family protein 0.0201 0.8686 0.9975
Brugia malayi Bromodomain containing protein 0.0202 0.8707 1
Echinococcus multilocularis peregrin 0.0215 0.9368 1
Echinococcus multilocularis enhancer of polycomb 0.0033 0.0719 0.0206
Plasmodium falciparum phd finger protein, putative 0.0053 0.1704 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0537 0.0635
Loa Loa (eye worm) jmjC domain-containing protein 0.0036 0.0877 0.1009
Giardia lamblia PHD finger protein 15 0.0053 0.1704 0.5
Loa Loa (eye worm) PHD-finger family protein 0.0053 0.1704 0.1962
Brugia malayi RNA binding protein 0.0061 0.2068 0.2375
Schistosoma mansoni enhancer of polycomb 0.0033 0.0719 0.085
Schistosoma mansoni enhancer of polycomb 0.0033 0.0719 0.085
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0017 0 0.5
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0017 0 0.5
Plasmodium vivax hypothetical protein, conserved 0.0053 0.1704 1
Trichomonas vaginalis set domain proteins, putative 0.0229 1 1
Echinococcus multilocularis enhancer of polycomb 0.0033 0.0719 0.0206
Loa Loa (eye worm) hypothetical protein 0.0053 0.1704 0.1962
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0537 0.0635
Loa Loa (eye worm) RNA binding protein 0.0061 0.2068 0.2381
Plasmodium vivax SET domain protein, putative 0.0029 0.0537 0.3153
Echinococcus multilocularis tar DNA binding protein 0.0061 0.2068 0.1734
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0036 0.0877 0.0384
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0201 0.8686 1
Schistosoma mansoni enhancer of polycomb 0.0033 0.0719 0.085
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0036 0.0877 0.0439

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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