Detailed information for compound 783060

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 362.375 | Formula: C17H15FN2O4S
  • H donors: 2 H acceptors: 3 LogP: 2.78 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: C/N=c\1/c(NS(=O)(=O)c2ccc(c(c2)C)F)c(O)oc2c1cccc2
  • InChi: 1S/C17H15FN2O4S/c1-10-9-11(7-8-13(10)18)25(22,23)20-16-15(19-2)12-5-3-4-6-14(12)24-17(16)21/h3-9,20-21H,1-2H3
  • InChiKey: OKOBKIQHNCZWMJ-UHFFFAOYSA-N  


Substructure search Similarity search

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 nAChR subunit 0.0045 0.1023 0.0919
Echinococcus granulosus nAChR subunit 0.0074 0.3616 0.3981
Echinococcus multilocularis glycine receptor subunit beta 0.0074 0.3616 0.3981
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.0074 0.3616 0.3616
Brugia malayi Inositol-1 0.0036 0.0244 0.0244
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.013 0.8442 1
Loa Loa (eye worm) GABA receptor subunit 0.0045 0.1023 0.1023
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0074 0.3616 0.3616
Onchocerca volvulus 0.0074 0.3616 0.2889
Schistosoma mansoni nAChR subunit 0.0074 0.3616 0.3616
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0074 0.3616 0.3981
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0074 0.3616 0.3981
Loa Loa (eye worm) hypothetical protein 0.0045 0.1023 0.1023
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Toxoplasma gondii fumble protein 0.0077 0.3847 0.4395
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0074 0.3616 0.3981
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0074 0.3616 0.3616
Brugia malayi RNA binding protein 0.0124 0.7945 0.7945
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.013 0.8442 1
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.0074 0.3616 0.3981
Schistosoma mansoni rotamase 0.0133 0.8716 0.8716
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0074 0.3616 0.3616
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.004 0.0622 0.0461
Onchocerca volvulus 0.0147 1 1
Toxoplasma gondii PPIC-type PPIASE domain-containing protein 0.004 0.0622 0.0461
Brugia malayi Cation transporter family protein 0.0074 0.3616 0.3616
Trichomonas vaginalis pantothenate kinase, putative 0.0077 0.3847 0.4253
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0074 0.3616 0.3616
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.0133 0.8716 0.8716
Plasmodium vivax pantothenate kinase, putative 0.0077 0.3847 0.5
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0074 0.3616 0.3981
Echinococcus granulosus glycine receptor subunit beta 0.0074 0.3616 0.3981
Schistosoma mansoni neurotransmitter gated ion channel 0.0045 0.1023 0.1023
Onchocerca volvulus 0.0074 0.3616 0.2889
Loa Loa (eye worm) hypothetical protein 0.0118 0.7407 0.7407
Loa Loa (eye worm) LGC-31 protein 0.0074 0.3616 0.3616
Echinococcus multilocularis nAChR subunit 0.0045 0.1023 0.0919
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0036 0.0244 0.5
Schistosoma mansoni tar DNA-binding protein 0.0124 0.7945 0.7945
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.0045 0.1023 0.1023
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0147 1 1
Wolbachia endosymbiont of Brugia malayi parvulin-like peptidyl-prolyl isomerase, PPID 0.004 0.0622 1
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.0074 0.3616 0.3616
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0074 0.3616 0.3616
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0147 1 1
Loa Loa (eye worm) pantothenate kinase 0.0077 0.3847 0.3847
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0074 0.3616 0.3616
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0074 0.3616 0.3616
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.0074 0.3616 0.3981
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.0074 0.3616 0.3981
Loa Loa (eye worm) hypothetical protein 0.0045 0.1023 0.1023
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.0074 0.3616 0.3616
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Leishmania major pantothenate kinase subunit, putative 0.0077 0.3847 0.4395
Toxoplasma gondii peptidylprolyl isomerase 0.013 0.8442 1
Echinococcus granulosus expressed protein 0.0133 0.8716 1
Schistosoma mansoni nAChR subunit 0.0074 0.3616 0.3616
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.013 0.8442 1
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.0074 0.3616 0.3981
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0074 0.3616 0.3981
Brugia malayi Cytochrome P450 family protein 0.0048 0.1257 0.1257
Loa Loa (eye worm) hypothetical protein 0.0045 0.1023 0.1023
Plasmodium falciparum pantothenate kinase 1, putative 0.0077 0.3847 0.5
Schistosoma mansoni tar DNA-binding protein 0.0124 0.7945 0.7945
Loa Loa (eye worm) RNA binding protein 0.0124 0.7945 0.7945
Trypanosoma cruzi pantothenate kinase subunit, putative 0.0077 0.3847 0.4395
Entamoeba histolytica hypothetical protein 0.0045 0.1023 0.095
Schistosoma mansoni nAChR subunit 0.0074 0.3616 0.3616
Echinococcus multilocularis expressed protein 0.0133 0.8716 1
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Loa Loa (eye worm) hypothetical protein 0.0049 0.1349 0.1349
Schistosoma mansoni tar DNA-binding protein 0.0124 0.7945 0.7945
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative 0.004 0.0622 0.0461
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Loa Loa (eye worm) hypothetical protein 0.0147 1 1
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.0074 0.3616 0.3616
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Schistosoma mansoni inositol monophosphatase 0.0036 0.0244 0.0244
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0045 0.1023 0.1023
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.013 0.8442 1
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.0074 0.3616 0.3981
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0074 0.3616 0.3981
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0074 0.3616 0.3616
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0045 0.1023 0.1023
Schistosoma mansoni nicotinic acetylcholine receptor alpha 0.0045 0.1023 0.1023
Trichomonas vaginalis conserved hypothetical protein 0.0133 0.8716 1
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0074 0.3616 0.3981
Echinococcus multilocularis nAChR subunit 0.0074 0.3616 0.3981
Loa Loa (eye worm) hypothetical protein 0.0045 0.1023 0.1023
Loa Loa (eye worm) hypothetical protein 0.0147 1 1
Echinococcus granulosus tar DNA binding protein 0.0124 0.7945 0.9091
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0074 0.3616 0.3616
Echinococcus multilocularis glycine receptor subunit beta 0.0074 0.3616 0.3981
Leishmania major peptidyl-prolyl cis-trans isomerase, putative 0.004 0.0622 0.0461
Loa Loa (eye worm) TAR-binding protein 0.0124 0.7945 0.7945
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0074 0.3616 0.3981
Trichomonas vaginalis pantothenate kinase, putative 0.0077 0.3847 0.4253
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.0074 0.3616 0.3616
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.1349 0.1349
Trichomonas vaginalis pantothenate kinase, putative 0.0077 0.3847 0.4253
Loa Loa (eye worm) cytochrome P450 family protein 0.0048 0.1257 0.1257
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.0133 0.8716 0.8716
Echinococcus granulosus glycine receptor subunit beta 0.0074 0.3616 0.3981
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0074 0.3616 0.3616
Loa Loa (eye worm) hypothetical protein 0.0045 0.1023 0.1023
Onchocerca volvulus Fumble homolog 0.0077 0.3847 0.3146
Loa Loa (eye worm) ACC-1 protein 0.0074 0.3616 0.3616
Loa Loa (eye worm) hypothetical protein 0.0045 0.1023 0.1023
Echinococcus granulosus pantothenate kinase 4 0.0077 0.3847 0.4253
Schistosoma mansoni nAChR subunit 0.0074 0.3616 0.3616
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0124 0.7945 0.7945
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.0074 0.3616 0.3616
Onchocerca volvulus 0.0074 0.3616 0.2889
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0045 0.1023 0.1023
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.0074 0.3616 0.3616
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0074 0.3616 0.3616
Echinococcus granulosus glycine receptor subunit alpha 1 0.0074 0.3616 0.3981
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0074 0.3616 0.3981
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.0074 0.3616 0.3616
Brugia malayi pantothenate kinase family protein 0.0077 0.3847 0.3847
Entamoeba histolytica pantothenate kinase 1, putative 0.0077 0.3847 0.4395
Loa Loa (eye worm) ACC-1 protein 0.0074 0.3616 0.3616
Loa Loa (eye worm) inositol-1 0.0036 0.0244 0.0244
Schistosoma mansoni pantothenate kinase 0.0077 0.3847 0.3847
Brugia malayi excitatory GABA receptor EXP-1A 0.0074 0.3616 0.3616
Brugia malayi RNA recognition motif domain containing protein 0.0124 0.7945 0.7945
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0074 0.3616 0.3616
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0074 0.3616 0.3981
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.1349 0.1349
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0074 0.3616 0.3616
Trypanosoma brucei pantothenate kinase subunit, putative 0.0077 0.3847 0.4395
Trichomonas vaginalis rotamase, putative 0.0133 0.8716 1
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.0074 0.3616 0.3981
Onchocerca volvulus 0.0147 1 1
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Trichomonas vaginalis conserved hypothetical protein 0.0045 0.0991 0.0882
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0074 0.3616 0.3616
Echinococcus granulosus glycine receptor subunit alpha 1 0.0074 0.3616 0.3981
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0074 0.3616 0.3616
Trypanosoma cruzi pantothenate kinase subunit, putative 0.0077 0.3847 0.4395
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Schistosoma mansoni nAChR subunit 0.0074 0.3616 0.3616
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.0074 0.3616 0.3616
Trichomonas vaginalis pantothenate kinase, putative 0.0077 0.3847 0.4253
Loa Loa (eye worm) hypothetical protein 0.0045 0.1023 0.1023
Schistosoma mansoni pantothenate kinase 0.0077 0.3847 0.3847
Schistosoma mansoni inositol monophosphatase 0.0036 0.0244 0.0244
Echinococcus multilocularis pantothenate kinase 4 0.0077 0.3847 0.4253
Onchocerca volvulus Putative nachr subunit 0.0074 0.3616 0.2889
Schistosoma mansoni nAChR subunit 0.0074 0.3616 0.3616
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.0074 0.3616 0.3981
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.004 0.0622 0.0461
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.0074 0.3616 0.3616
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.013 0.8442 1
Echinococcus multilocularis tar DNA binding protein 0.0124 0.7945 0.9091
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0045 0.1023 0.1023
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.1349 0.1349
Trichomonas vaginalis rotamase, putative 0.013 0.8442 0.9677
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0074 0.3616 0.3616
Trichomonas vaginalis pantothenate kinase, putative 0.0077 0.3847 0.4253
Echinococcus granulosus glycine receptor subunit alpha 1 0.0074 0.3616 0.3981
Giardia lamblia Pantothenate kinase 4 0.0077 0.3847 0.5
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Onchocerca volvulus 0.0147 1 1
Loa Loa (eye worm) hypothetical protein 0.0045 0.1023 0.1023
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0074 0.3616 0.3981
Brugia malayi Cation transporter family protein 0.0074 0.3616 0.3616
Brugia malayi TAR-binding protein 0.0124 0.7945 0.7945
Schistosoma mansoni tar DNA-binding protein 0.0124 0.7945 0.7945
Loa Loa (eye worm) hypothetical protein 0.0074 0.3616 0.3616
Schistosoma mansoni nAChR subunit 0.0074 0.3616 0.3616
Schistosoma mansoni tar DNA-binding protein 0.0124 0.7945 0.7945

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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