Detailed information for compound 811776

Basic information

Technical information
  • TDR Targets ID: 811776
  • Name: 2,2,3,3-tetrafluoropropyl N-(3-chloro-4-methy lphenyl)carbamate
  • MW: 299.649 | Formula: C11H10ClF4NO2
  • H donors: 1 H acceptors: 1 LogP: 4.02 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccc(c(c1)Cl)C)OCC(C(F)F)(F)F
  • InChi: 1S/C11H10ClF4NO2/c1-6-2-3-7(4-8(6)12)17-10(18)19-5-11(15,16)9(13)14/h2-4,9H,5H2,1H3,(H,17,18)
  • InChiKey: VSRPLPXUFFDLPF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2,2,3,3-tetrafluoropropyl N-(3-chloro-4-methyl-phenyl)carbamate
  • N-(3-chloro-4-methylphenyl)carbamic acid 2,2,3,3-tetrafluoropropyl ester
  • N-(3-chloro-4-methyl-phenyl)carbamic acid 2,2,3,3-tetrafluoropropyl ester
  • BIM-0021571.P001
  • CBMicro_021578
  • ZINC00248346

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
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0084 0.3594 1
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.0049 0.1328 0.1328
Schistosoma mansoni glutamate receptor AMPA 0.0041 0.0814 0.0814
Toxoplasma gondii aldehyde dehydrogenase 0.007 0.2705 0.644
Loa Loa (eye worm) hypothetical protein 0.0101 0.4726 0.5501
Echinococcus granulosus fatty acid amide hydrolase 1 0.0101 0.4726 0.4726
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0084 0.3594 1
Echinococcus multilocularis nmda type glutamate receptor 0.0097 0.443 0.443
Schistosoma mansoni glutamate receptor AMPA 0.0041 0.0814 0.0814
Loa Loa (eye worm) hypothetical protein 0.0053 0.1604 0.1867
Schistosoma mansoni hypothetical protein 0.0182 1 1
Onchocerca volvulus 0.0029 0 0.5
Brugia malayi Probable ClpP-like protease 0.0084 0.3594 0.4184
Echinococcus granulosus glutamate receptor NMDA 0.0081 0.3428 0.3428
Schistosoma mansoni amidase 0.0101 0.4726 0.4726
Brugia malayi acetyltransferase, GNAT family protein 0.0155 0.8279 0.9637
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0049 0.1328 0.1328
Onchocerca volvulus 0.0029 0 0.5
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0084 0.3594 1
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0101 0.4726 0.4726
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0049 0.1328 0.1328
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0053 0.1604 0.1867
Echinococcus granulosus glutamate receptor 2 0.0049 0.1328 0.1328
Echinococcus granulosus peptidase Clp S14 family 0.0055 0.1703 0.1703
Onchocerca volvulus 0.0029 0 0.5
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0084 0.3594 1
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0049 0.1328 0.1328
Loa Loa (eye worm) acetyltransferase 0.0155 0.8279 0.9637
Loa Loa (eye worm) hypothetical protein 0.016 0.8591 1
Schistosoma mansoni glutamate receptor kainate 0.0041 0.0814 0.0814
Brugia malayi Calcitonin receptor-like protein seb-1 0.0053 0.1604 0.1867
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0084 0.3594 1
Onchocerca volvulus 0.0029 0 0.5
Schistosoma mansoni glutamate receptor kainate 0.0041 0.0814 0.0814
Schistosoma mansoni hypothetical protein 0.0037 0.0497 0.0497
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0155 0.8279 0.8279
Onchocerca volvulus 0.0029 0 0.5
Echinococcus granulosus histone acetyltransferase KAT2B 0.0151 0.7994 0.7994
Onchocerca volvulus 0.0029 0 0.5
Schistosoma mansoni glutamate receptor NMDA 0.0098 0.454 0.454
Onchocerca volvulus 0.0029 0 0.5
Onchocerca volvulus Neuropeptide F receptor homolog 0.0029 0 0.5
Schistosoma mansoni glutamate receptor kainate 0.0041 0.0814 0.0814
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0084 0.3594 0.3594
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0049 0.1328 0.1328
Onchocerca volvulus 0.0029 0 0.5
Echinococcus multilocularis peptidase Clp (S14 family) 0.0055 0.1703 0.1703
Giardia lamblia Histone acetyltransferase GCN5 0.0042 0.0847 0.5
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0084 0.3594 1
Trichomonas vaginalis bromodomain-containing protein, putative 0.0046 0.1097 0.5
Echinococcus multilocularis nmda type glutamate receptor 0.0089 0.3941 0.3941
Brugia malayi Glutamate receptor 1 precursor 0.0041 0.0814 0.0947
Onchocerca volvulus 0.0029 0 0.5
Schistosoma mansoni hypothetical protein 0.0182 1 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0084 0.3594 0.5
Brugia malayi latrophilin 2 splice variant baaae 0.0037 0.0497 0.0578
Echinococcus granulosus glutamate NMDA receptor subunit 0.0098 0.454 0.454
Entamoeba histolytica acetyltransferase, GNAT family 0.0042 0.0847 0.5
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0084 0.3594 1
Onchocerca volvulus 0.0029 0 0.5
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0049 0.1328 0.1328
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0053 0.1604 0.1867
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0084 0.3594 0.3594
Loa Loa (eye worm) glutamate receptor 1 0.0041 0.0814 0.0947
Onchocerca volvulus 0.0029 0 0.5
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0084 0.3594 0.5
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.0049 0.1328 0.1328
Echinococcus multilocularis muscleblind protein 1 0.016 0.8591 0.8591
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0084 0.3594 0.5
Echinococcus multilocularis glutamate receptor 2 0.0034 0.0325 0.0325
Schistosoma mansoni peptidase Clp (S14 family) 0.0084 0.3594 0.3594
Echinococcus multilocularis glutamate receptor 2 0.0041 0.0814 0.0814
Echinococcus granulosus fatty acid amide hydrolase 1 0.0101 0.4726 0.4726
Onchocerca volvulus 0.0029 0 0.5
Echinococcus granulosus nmda type glutamate receptor 0.0089 0.3941 0.3941
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.007 0.2705 0.5
Loa Loa (eye worm) hypothetical protein 0.016 0.8591 1
Schistosoma mansoni glutamate receptor NMDA 0.0131 0.6651 0.6651
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0029 0 0.5
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0046 0.1097 0.5
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.007 0.2705 0.2705
Echinococcus granulosus muscleblind protein 0.016 0.8591 0.8591
Echinococcus multilocularis geminin 0.0182 1 1
Echinococcus multilocularis muscleblind protein 0.016 0.8591 0.8591
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0049 0.1328 0.1328
Schistosoma mansoni aldehyde dehydrogenase 0.007 0.2705 0.2705
Echinococcus multilocularis glutamate receptor 2 0.0049 0.1328 0.1328
Echinococcus multilocularis glutamate receptor NMDA 0.0081 0.3428 0.3428
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0084 0.3594 0.5
Brugia malayi Glutamate receptor 2 precursor 0.0041 0.0814 0.0947
Onchocerca volvulus 0.0029 0 0.5
Onchocerca volvulus 0.0029 0 0.5
Schistosoma mansoni aldehyde dehydrogenase 0.007 0.2705 0.2705
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.007 0.2705 0.2705
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0101 0.4726 0.4726
Onchocerca volvulus 0.0029 0 0.5
Echinococcus multilocularis glutamate (NMDA) receptor subunit 0.0098 0.454 0.454
Onchocerca volvulus 0.0029 0 0.5
Brugia malayi Muscleblind-like protein 0.016 0.8591 1
Schistosoma mansoni fatty-acid amide hydrolase 0.0101 0.4726 0.4726
Schistosoma mansoni ATP-binding cassette transporter 0.0041 0.0814 0.0814
Onchocerca volvulus 0.0029 0 0.5
Echinococcus granulosus glutamate receptor 2 0.0034 0.0325 0.0325
Echinococcus granulosus nmda type glutamate receptor 0.0097 0.443 0.443
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0155 0.8279 0.8279
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.007 0.2705 1
Loa Loa (eye worm) glutamate receptor 2 0.0041 0.0814 0.0947
Loa Loa (eye worm) hypothetical protein 0.0037 0.0497 0.0578
Echinococcus granulosus histone acetyltransferase KAT2B 0.0046 0.1097 0.1097
Brugia malayi amidase 0.0101 0.4726 0.5501
Loa Loa (eye worm) hypothetical protein 0.0084 0.3594 0.4184

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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