Detailed information for compound 1159436

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 246.714 | Formula: C9H11ClN2O2S
  • H donors: 1 H acceptors: 2 LogP: 1.14 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)CN1CCNS1(=O)=O
  • InChi: 1S/C9H11ClN2O2S/c10-9-3-1-8(2-4-9)7-12-6-5-11-15(12,13)14/h1-4,11H,5-7H2
  • InChiKey: YBJTWRKNUZAYLV-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 terminal deoxycytidyl transferase rev1 0.0023 0.1683 0.1264
Loa Loa (eye worm) hypothetical protein 0.003 0.3557 0.3397
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0043 0.6638 0.6924
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0023 0.1683 0.1264
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.1683 0.1904
Schistosoma mansoni hypothetical protein 0.0039 0.5653 0.5932
Loa Loa (eye worm) hypothetical protein 0.0029 0.3208 0.3039
Trypanosoma cruzi PAB1-binding protein , putative 0.0029 0.3208 0.2131
Brugia malayi intermediate filament protein 0.0031 0.3693 0.3537
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.9112 1
Leishmania major DNA polymerase eta, putative 0.0037 0.5101 0.4775
Trypanosoma cruzi PAB1-binding protein , putative 0.0029 0.3208 0.2131
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.9112 1
Loa Loa (eye worm) inositol-1 0.0043 0.6638 0.6554
Echinococcus multilocularis lamin 0.0031 0.3693 0.3628
Brugia malayi hypothetical protein 0.0019 0.0746 0.0516
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1683 0.1904
Schistosoma mansoni terminal deoxycytidyl transferase 0.0023 0.1683 0.1264
Echinococcus granulosus dna polymerase kappa 0.0023 0.1683 0.1264
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0043 0.6638 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.9112 1
Trypanosoma brucei DNA polymerase eta, putative 0.0052 0.884 1
Brugia malayi hypothetical protein 0.0029 0.3208 0.3039
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0018 0.0608 0.0375
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.1683 0.1904
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0053 0.9112 0.909
Loa Loa (eye worm) intermediate filament protein 0.0031 0.3693 0.3537
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1683 0.1904
Echinococcus granulosus lamin dm0 0.0031 0.3693 0.3628
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0037 0.5101 0.5518
Trypanosoma brucei PAB1-binding protein , putative 0.0029 0.3208 0.3629
Brugia malayi Calcitonin receptor-like protein seb-1 0.0057 1 1
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0039 0.555 0.5
Plasmodium vivax ataxin-2 like protein, putative 0.0029 0.3208 0.5
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0023 0.1683 0.1264
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0057 1 1
Schistosoma mansoni intermediate filament proteins 0.0031 0.3693 0.3628
Giardia lamblia DINP protein human, muc B family 0.0023 0.1683 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.9112 1
Echinococcus granulosus intermediate filament protein 0.0031 0.3693 0.3628
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1683 0.1904
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0043 0.6638 0.6924
Brugia malayi latrophilin 2 splice variant baaae 0.0039 0.5653 0.5545
Echinococcus multilocularis dna polymerase kappa 0.0023 0.1683 0.1264
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1683 0.1904
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0043 0.6638 0.5
Schistosoma mansoni inositol monophosphatase 0.0043 0.6638 0.7091
Echinococcus multilocularis musashi 0.0031 0.3693 0.3628
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0053 0.9112 0.909
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1683 0.1904
Leishmania major hypothetical protein, conserved 0.0029 0.3208 0.2131
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1683 0.1904
Brugia malayi ImpB/MucB/SamB family protein 0.0052 0.884 0.8811
Schistosoma mansoni DNA polymerase eta 0.0052 0.884 0.968
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0031 0.3693 0.3537
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1683 0.1904
Trypanosoma cruzi DNA polymerase eta, putative 0.0052 0.884 1
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0043 0.6638 0.7509
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.9112 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.3693 0.3537
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0043 0.6638 0.6924
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.9112 1
Leishmania major DNA polymerase eta, putative 0.0052 0.884 1
Brugia malayi Inositol-1 0.0043 0.6638 0.6554
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0043 0.6638 1
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.1683 0.1904
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0039 0.555 1
Echinococcus granulosus dna polymerase eta 0.0052 0.884 0.968
Brugia malayi Intermediate filament tail domain containing protein 0.0031 0.3693 0.3537
Schistosoma mansoni lamin 0.0031 0.3693 0.3628
Onchocerca volvulus 0.0031 0.3693 0.5
Echinococcus granulosus inositol monophosphatase 1 0.0043 0.6638 0.7091
Onchocerca volvulus 0.0031 0.3693 0.5
Schistosoma mansoni lamin 0.0031 0.3693 0.3628
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.1683 0.1476
Loa Loa (eye worm) hypothetical protein 0.0057 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1683 0.1904
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0043 0.6638 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0608 0.0375
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0023 0.1683 0.1476
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1683 0.1904
Plasmodium falciparum ataxin-2 like protein, putative 0.0029 0.3208 0.5
Brugia malayi Latrophilin receptor protein 2 0.0018 0.0608 0.0375
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.1683 0.1904
Loa Loa (eye worm) hypothetical protein 0.0052 0.884 0.8811
Trypanosoma cruzi DNA polymerase eta, putative 0.0037 0.5101 0.4775
Echinococcus multilocularis dna polymerase eta 0.0052 0.884 0.968
Echinococcus multilocularis inositol monophosphatase 1 0.0043 0.6638 0.7091
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0043 0.6638 1
Trichomonas vaginalis inositol monophosphatase, putative 0.0043 0.6638 1
Echinococcus granulosus lamin 0.0031 0.3693 0.3628
Echinococcus multilocularis lamin dm0 0.0031 0.3693 0.3628
Trypanosoma brucei unspecified product 0.0023 0.1683 0.1904
Loa Loa (eye worm) latrophilin receptor protein 2 0.0018 0.0608 0.0375
Loa Loa (eye worm) hypothetical protein 0.0039 0.5653 0.5545
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0043 0.6638 1
Schistosoma mansoni inositol monophosphatase 0.0043 0.6638 0.7091
Plasmodium falciparum ataxin-2 like protein, putative 0.0029 0.3208 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.9112 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.

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