Detailed information for compound 1637660

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 414.425 | Formula: C26H19FO4
  • H donors: 2 H acceptors: 3 LogP: 6.66 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: Fc1ccc(cc1)Cc1cc(O)c(c(c1)C(=O)c1ccc(cc1)Oc1ccccc1)O
  • InChi: 1S/C26H19FO4/c27-20-10-6-17(7-11-20)14-18-15-23(26(30)24(28)16-18)25(29)19-8-12-22(13-9-19)31-21-4-2-1-3-5-21/h1-13,15-16,28,30H,14H2
  • InChiKey: HPXSGUABWVEREJ-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

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 transient receptor potential ion channel A 0.0211 0.0938 0.4271
Loa Loa (eye worm) hypothetical protein 0.0218 0.0988 0.4639
Brugia malayi GH02984p 0.0385 0.213 1
Echinococcus multilocularis short transient receptor potential channel 6 0.0144 0.0482 0.2079
Plasmodium vivax dipeptidyl aminopeptidase 2, putative 0.1535 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0952 0.6014 0.5
Toxoplasma gondii preprocathepsin c precursor, putative 0.1535 1 1
Loa Loa (eye worm) hypothetical protein 0.0081 0.005 0.0234
Echinococcus granulosus short transient receptor potential channel 6 0.0144 0.0482 0.2079
Echinococcus granulosus high affinity choline transporter 1 0.0385 0.213 1
Echinococcus multilocularis short transient receptor potential channel 6 0.0144 0.0482 0.2079
Plasmodium falciparum dipeptidyl aminopeptidase 2 0.1535 1 1
Schistosoma mansoni dipeptidyl-peptidase I (C01 family) 0.1535 1 1
Echinococcus granulosus short transient receptor potential channel 6 0.0144 0.0482 0.2079
Plasmodium vivax dipeptidyl aminopeptidase 1, putative 0.1535 1 1
Echinococcus multilocularis transient receptor potential gamma protein 0.0218 0.0988 0.4511
Echinococcus granulosus transient receptor potential gamma protein 0.0218 0.0988 0.4511
Toxoplasma gondii cathepsin CPC1 0.1535 1 1
Loa Loa (eye worm) hypothetical protein 0.0137 0.0433 0.2031
Plasmodium falciparum dipeptidyl aminopeptidase 1 0.1535 1 1
Echinococcus multilocularis transient receptor potential ion channel A 0.0211 0.0938 0.4271
Loa Loa (eye worm) hypothetical protein 0.0385 0.213 1
Schistosoma mansoni high-affinity choline transporter 0.0385 0.213 0.1732
Schistosoma mansoni transient receptor potential channel 4 0.0218 0.0988 0.0532
Echinococcus multilocularis high affinity choline transporter 1 0.0385 0.213 1
Schistosoma mansoni transient receptor potential channel 0.0218 0.0988 0.0532

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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