Detailed information for compound 818336

Basic information

Technical information
  • TDR Targets ID: 818336
  • Name: 6-bromo-3-[(E)-3-(4-methoxyphenyl)prop-2-enoy l]-4-phenyl-1H-quinolin-2-one
  • MW: 460.319 | Formula: C25H18BrNO3
  • H donors: 1 H acceptors: 3 LogP: 6.78 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)C=CC(=O)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Br
  • InChi: 1S/C25H18BrNO3/c1-30-19-11-7-16(8-12-19)9-14-22(28)24-23(17-5-3-2-4-6-17)20-15-18(26)10-13-21(20)27-25(24)29/h2-15H,1H3,(H,27,29)/b14-9+
  • InChiKey: MHOYXOLOAAEANT-NTEUORMPSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 6-bromo-3-[3-(4-methoxyphenyl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one
  • 6-bromo-3-[3-(4-methoxyphenyl)-1-oxoprop-2-enyl]-4-phenyl-1H-quinolin-2-one
  • 6-bromo-3-[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]-4-phenyl-1H-quinolin-2-one
  • 6-bromo-3-[(E)-3-(4-methoxyphenyl)acryloyl]-4-phenyl-carbostyril
  • 6-bromo-3-[3-(4-methoxyphenyl)acryloyl]-4-phenyl-carbostyril
  • BIM-0013000.P001
  • CBMicro_013071
  • 6-Bromo-3-[3-(4-methoxy-phenyl)-acryloyl]-4-phenyl-1H-quinolin-2-one
  • BAS 00991414
  • A2178/0091497

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
Echinococcus granulosus mitogen activated protein kinase 11 0.6543 1 1
Echinococcus multilocularis mitogen activated protein kinase 11 0.6543 1 1
Echinococcus multilocularis mitogen activated protein kinase 14 0.6543 1 1
Echinococcus granulosus mitogen activated protein kinase 14 0.6543 1 1
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.6543 1 1
Loa Loa (eye worm) hypothetical protein 0.5379 0.8204 0.8204
Loa Loa (eye worm) hypothetical protein 0.5379 0.8204 0.8204
Toxoplasma gondii hypothetical protein 0.5379 0.8204 0.5
Loa Loa (eye worm) TK/DDR protein kinase 0.0319 0.0401 0.0401
Echinococcus multilocularis mitogen activated protein kinase 14 0.6543 1 1
Loa Loa (eye worm) TK/FAK protein kinase 0.0503 0.0686 0.0686
Leishmania major mitogen-activated protein kinase 3, putative,map kinase 3, putative 0.6543 1 1
Echinococcus multilocularis c Jun NH2 terminal kinase 0.0711 0.1006 0.0353
Trypanosoma brucei mitogen-activated protein kinase 3, putative 0.6543 1 1
Brugia malayi Cytochrome P450 family protein 0.0153 0.0146 0.0146
Echinococcus granulosus protein tyrosine kinase 0.0498 0.0677 0.023
Loa Loa (eye worm) CMGC/MAPK/P38 protein kinase 0.6543 1 1
Brugia malayi Protein kinase domain containing protein 0.0503 0.0686 0.0686
Schistosoma mansoni serine/threonine protein kinase 0.0711 0.1006 1
Loa Loa (eye worm) hypothetical protein 0.0355 0.0458 0.0458
Echinococcus granulosus c-Jun N-terminal kinases 0.0711 0.1006 0.0574
Loa Loa (eye worm) cytochrome P450 family protein 0.0153 0.0146 0.0146
Loa Loa (eye worm) hypothetical protein 0.0319 0.0401 0.0401
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.6543 1 1
Loa Loa (eye worm) CMGC/MAPK/JNK protein kinase 0.0711 0.1006 0.1006
Brugia malayi Stress-activated protein kinase jnk-1 0.0711 0.1006 0.1006
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0058 0 0.5
Echinococcus multilocularis mitogen activated protein kinase 11 0.6543 1 1
Brugia malayi Protein kinase domain containing protein 0.0363 0.047 0.047
Onchocerca volvulus 0.0363 0.047 0.5
Loa Loa (eye worm) inward rectifying k channel family protein 1 0.5379 0.8204 0.8204
Loa Loa (eye worm) hypothetical protein 0.5379 0.8204 0.8204

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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