Detailed information for compound 793385

Basic information

Technical information
  • TDR Targets ID: 793385
  • Name: ZINC02460996
  • MW: 377.453 | Formula: C18H16FNO3S2
  • H donors: 0 H acceptors: 3 LogP: 4.87 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(Sc1oc(nc1S(=O)(=O)c1ccccc1)c1ccc(cc1)F)C
  • InChi: 1S/C18H16FNO3S2/c1-12(2)24-18-17(25(21,22)15-6-4-3-5-7-15)20-16(23-18)13-8-10-14(19)11-9-13/h3-12H,1-2H3
  • InChiKey: JSOBOFNTKVIJAB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

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 multilocularis expressed conserved protein 0.0099 0.4369 0.484
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0102 0.4617 0.4359
Echinococcus multilocularis glutamate receptor NMDA 0.0079 0.2497 0.2755
Echinococcus granulosus expressed conserved protein 0.0099 0.4369 0.484
Loa Loa (eye worm) hypothetical protein 0.0102 0.4617 0.4359
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.007 0.1761 0.1936
Loa Loa (eye worm) hypothetical protein 0.0106 0.4942 0.47
Echinococcus granulosus nmda type glutamate receptor 0.0149 0.8773 0.9747
Chlamydia trachomatis arginine ABC transporter substrate-binding protein ArtJ 0.0051 0 0.5
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0106 0.4942 0.5
Treponema pallidum amino acid ABC transporter, periplasmic binding protein 0.0051 0 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0102 0.4617 0.3493
Chlamydia trachomatis glutamine binding protein 0.0051 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0163 1 1
Echinococcus granulosus nmda type glutamate receptor 0.0089 0.34 0.3761
Loa Loa (eye worm) hypothetical protein 0.007 0.1728 0.1332
Schistosoma mansoni glutamate receptor NMDA 0.0129 0.7036 1
Onchocerca volvulus 0.0163 1 0.5
Echinococcus granulosus Niemann Pick C1 protein 0.0106 0.4942 0.5479
Mycobacterium tuberculosis Probable glutamine-binding lipoprotein GlnH (GLNBP) 0.0051 0 0.5
Mycobacterium ulcerans glutamine-binding lipoprotein GlnH 0.0051 0 0.5
Echinococcus granulosus glutamate receptor NMDA 0.0079 0.2497 0.2755
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0102 0.4617 0.3493
Treponema pallidum amino acid ABC transporter, periplasmic binding protein (hisJ) 0.0051 0 0.5
Echinococcus multilocularis Niemann Pick C1 protein 0.0106 0.4942 0.5479
Echinococcus multilocularis nmda type glutamate receptor 0.0089 0.34 0.3761
Brugia malayi Niemann-Pick C1 protein precursor 0.0106 0.4942 0.3886
Echinococcus multilocularis protein dispatched 1 0.0052 0.0117 0.0104
Echinococcus multilocularis nmda type glutamate receptor 0.0149 0.8773 0.9747
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0108 0.5089 0.6332
Echinococcus granulosus Niemann Pick C1 protein 0.0151 0.9 1
Echinococcus multilocularis Niemann Pick C1 protein 0.0151 0.9 1

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.