Detailed information for compound 1476516

Basic information

Technical information
  • TDR Targets ID: 1476516
  • Name: 4-chloro-N-(3-morpholin-4-ylpropyl)-N-(thioph en-2-ylmethyl)benzenesulfonamide
  • MW: 414.97 | Formula: C18H23ClN2O3S2
  • H donors: 0 H acceptors: 2 LogP: 2.93 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)S(=O)(=O)N(Cc1cccs1)CCCN1CCOCC1
  • InChi: 1S/C18H23ClN2O3S2/c19-16-4-6-18(7-5-16)26(22,23)21(15-17-3-1-14-25-17)9-2-8-20-10-12-24-13-11-20/h1,3-7,14H,2,8-13,15H2
  • InChiKey: RDOGBTPYAVNWJF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-chloro-N-(3-morpholinopropyl)-N-(2-thienylmethyl)benzenesulfonamide
  • ChemDiv2_008332
  • EU-0064230

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
Brugia malayi diacylglycerol kinase 0.0065 0.111 0.111
Schistosoma mansoni serine/threonine protein kinase 0.026 0.5152 0.4976
Onchocerca volvulus 0.0028 0.035 0.0403
Schistosoma mansoni protein kinase C mu 0.0188 0.3665 0.3435
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0074 0.1309 0.1309
Trichomonas vaginalis AGC family protein kinase 0.0074 0.1309 0.5622
Onchocerca volvulus 0.0187 0.3642 0.4194
Loa Loa (eye worm) hypothetical protein 0.0065 0.111 0.111
Loa Loa (eye worm) RasGEF domain-containing protein 0.0065 0.111 0.111
Schistosoma mansoni hypothetical protein 0.0398 0.8 0.7928
Loa Loa (eye worm) hypothetical protein 0.0065 0.111 0.111
Trichomonas vaginalis AGC family protein kinase 0.0074 0.1309 0.5622
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.0074 0.1309 0.1215
Onchocerca volvulus 0.0431 0.8682 1
Trypanosoma cruzi Wee1-like protein kinase, putative 0.0171 0.3305 0.5
Schistosoma mansoni rac gtpase activating protein 0.0065 0.111 0.0787
Loa Loa (eye worm) AGC/AKT protein kinase 0.0078 0.1391 0.1391
Entamoeba histolytica PH domain containing protein kinase, putative 0.0143 0.2737 1
Entamoeba histolytica protein kinase, putative 0.0078 0.1391 0.5074
Loa Loa (eye worm) hypothetical protein 0.0115 0.2152 0.2152
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0065 0.111 0.0787
Loa Loa (eye worm) hypothetical protein 0.0333 0.6663 0.6663
Brugia malayi Ras association domain family 1 isoform A 0.0065 0.111 0.111
Loa Loa (eye worm) hypothetical protein 0.0187 0.3642 0.3642
Echinococcus multilocularis Protein lozenge 0.0054 0.089 0.0666
Echinococcus multilocularis guanine nucleotide exchange factor VAV2 0.0065 0.111 0.0954
Entamoeba histolytica protein kinase, putative 0.0074 0.1309 0.4772
Trichomonas vaginalis AGC family protein kinase 0.0078 0.1391 1
Brugia malayi Protein kinase domain containing protein 0.0074 0.1309 0.1309
Loa Loa (eye worm) hypothetical protein 0.0118 0.2221 0.2221
Echinococcus multilocularis Protein kinase C, brain isozyme 0.026 0.5152 0.6261
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.0074 0.1309 0.1215
Echinococcus multilocularis serine:threonine protein kinase 38 0.0074 0.1309 0.1215
Schistosoma mansoni protein kinase C mu 0.0065 0.111 0.0787
Trichomonas vaginalis AGC family protein kinase 0.0078 0.1391 1
Echinococcus multilocularis serine:threonine protein kinase N2 0.0208 0.4085 0.486
Schistosoma mansoni unc-13 (munc13) 0.0071 0.1236 0.0918
Echinococcus multilocularis Diacylglycerol kinase theta 0.0065 0.111 0.0954
Schistosoma mansoni serine/threonine protein kinase 0.0074 0.1309 0.0993
Echinococcus multilocularis raf serine:threonine protein kinase 0.0065 0.111 0.0954
Trypanosoma brucei wee1-like protein kinase 0.0171 0.3305 1
Loa Loa (eye worm) hypothetical protein 0.0065 0.111 0.111
Brugia malayi protein kinase C3,putative 0.015 0.2874 0.2874
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.0074 0.1309 0.1215
Brugia malayi protein kinase C II. 0.0279 0.5549 0.5549
Echinococcus granulosus Diacylglycerol kinase theta 0.0065 0.111 0.0954
Echinococcus granulosus protein kinase c eta type 0.0065 0.111 0.0954
Echinococcus granulosus serine:threonine protein kinase N2 0.0139 0.2655 0.2982
Schistosoma mansoni serine/threonine protein kinase 0.007 0.1216 0.0897
Entamoeba histolytica protein kinase, putative 0.0074 0.1309 0.4772
Entamoeba histolytica diacylglycerol kinase, putative 0.0065 0.111 0.4045
Echinococcus granulosus raf serine:threonine protein kinase 0.0065 0.111 0.0954
Loa Loa (eye worm) hypothetical protein 0.0431 0.8682 0.8682
Schistosoma mansoni serine/threonine protein kinase 0.0074 0.1309 0.0993
Trypanosoma cruzi Wee1-like protein kinase, putative 0.0171 0.3305 0.5
Schistosoma mansoni lozenge 0.0054 0.089 0.056
Loa Loa (eye worm) hypothetical protein 0.0069 0.1192 0.1192
Onchocerca volvulus 0.0183 0.3559 0.4099
Echinococcus multilocularis unc 13 (munc13) 0.0071 0.1236 0.112
Entamoeba histolytica hypothetical protein 0.0065 0.111 0.4045
Leishmania major protein kinase, putative,serine/threonine protein kinase, putative 0.0171 0.3305 0.5
Echinococcus granulosus C2 calcium dependent membrane targeting 0.0071 0.1236 0.112
Echinococcus multilocularis N chimaerin 0.0065 0.111 0.0954
Toxoplasma gondii AGC kinase 0.0074 0.1309 1
Echinococcus granulosus N chimaerin 0.0065 0.111 0.0954
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0188 0.3665 0.3665
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0059 0.0998 0.0671
Schistosoma mansoni serine/threonine protein kinase 0.0279 0.5549 0.5387
Echinococcus granulosus myotubularin protein 13 0.0069 0.1192 0.1063
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.0074 0.1309 0.1215
Loa Loa (eye worm) hypothetical protein 0.0118 0.2221 0.2221
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.035 0.035
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0074 0.1309 0.1309
Echinococcus granulosus guanine nucleotide exchange factor VAV2 0.0065 0.111 0.0954
Brugia malayi Protein kinase domain containing protein 0.0074 0.1309 0.1309
Loa Loa (eye worm) hypothetical protein 0.0268 0.5325 0.5325
Loa Loa (eye worm) hypothetical protein 0.0071 0.1236 0.1236
Entamoeba histolytica protein kinase, putative 0.0078 0.1391 0.5074
Echinococcus granulosus protein kinase c iota type 0.0219 0.4305 0.5148
Echinococcus granulosus dnaJ subfamily B 0.0398 0.8 1
Brugia malayi Hr1 repeat family protein 0.0074 0.1309 0.1309
Loa Loa (eye worm) hypothetical protein 0.018 0.349 0.349
Echinococcus multilocularis protein kinase c eta type 0.0065 0.111 0.0954
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.0126 0.2384 0.2384
Echinococcus multilocularis protein kinase c iota type 0.0219 0.4305 0.5148
Schistosoma mansoni cpg binding protein 0.003 0.0383 0.0034
Echinococcus granulosus Rac GTPase activating protein 1 0.0065 0.111 0.0954
Trichomonas vaginalis AGC family protein kinase 0.0078 0.1391 1
Echinococcus multilocularis serine threonine protein kinase 0.0195 0.3815 0.4505
Loa Loa (eye worm) AGC/NDR protein kinase 0.0074 0.1309 0.1309
Schistosoma mansoni serine/threonine protein kinase 0.007 0.1216 0.0897
Schistosoma mansoni unc-13 (munc13) 0.0071 0.1236 0.0918
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0074 0.1309 0.1309
Brugia malayi RhoGEF domain containing protein 0.0065 0.111 0.111
Schistosoma mansoni diacylglycerol kinase theta 0.0065 0.111 0.0787
Onchocerca volvulus 0.0268 0.5325 0.6133
Schistosoma mansoni hypothetical protein 0.0065 0.111 0.0787
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.0074 0.1309 0.1309
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0115 0.2152 0.2322
Loa Loa (eye worm) hypothetical protein 0.0268 0.5325 0.5325
Trichomonas vaginalis AGC family protein kinase 0.0078 0.1391 1
Loa Loa (eye worm) hypothetical protein 0.0343 0.6861 0.6861
Loa Loa (eye worm) hypothetical protein 0.0065 0.111 0.111
Loa Loa (eye worm) RhoGAP domain-containing protein 0.0065 0.111 0.111
Loa Loa (eye worm) AGC/PKC/IOTA protein kinase 0.0156 0.2996 0.2996
Brugia malayi Protein kinase domain containing protein 0.0078 0.1391 0.1391
Trichomonas vaginalis AGC family protein kinase 0.0078 0.1391 1
Echinococcus granulosus Serine/threonine-protein kinase Genghis Khan 0.007 0.1216 0.1093
Schistosoma mansoni serine/threonine kinase 0.0074 0.1309 0.0993
Brugia malayi C1-like domain containing protein 0.0188 0.3665 0.3665
Echinococcus multilocularis serine:threonine protein kinase MRCK beta 0.007 0.1216 0.1093
Schistosoma mansoni vav2 0.0069 0.1192 0.0873
Trypanosoma cruzi Wee1-like protein kinase, putative 0.0171 0.3305 0.5
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0123 0.2327 0.2327
Echinococcus multilocularis serine:threonine protein kinase N2 0.0074 0.1309 0.1215
Echinococcus multilocularis protein kinase c epsilon type 0.0279 0.5549 0.6782
Brugia malayi CXXC zinc finger family protein 0.0028 0.035 0.035
Brugia malayi Protein kinase domain containing protein 0.007 0.1216 0.1216
Brugia malayi hypothetical protein 0.0431 0.8682 0.8682
Schistosoma mansoni serine/threonine protein kinase 0.0074 0.1309 0.0993
Loa Loa (eye worm) hypothetical protein 0.0065 0.111 0.111
Brugia malayi Protein kinase c protein 2 0.0191 0.3722 0.3722
Loa Loa (eye worm) runx1 0.0054 0.089 0.089
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.0074 0.1309 0.1215
Brugia malayi diacylglycerol kinase 0.0065 0.111 0.111
Trichomonas vaginalis AGC family protein kinase 0.0078 0.1391 1
Brugia malayi Phorbol esters/diacylglycerol binding domain 0.0188 0.3665 0.3665
Schistosoma mansoni diacylglycerol kinase theta 0.0065 0.111 0.0787
Onchocerca volvulus 0.0118 0.2221 0.2559
Loa Loa (eye worm) hypothetical protein 0.0431 0.8682 0.8682
Echinococcus multilocularis myotubularin protein 13 0.0069 0.1192 0.1063
Schistosoma mansoni serine/threonine protein kinase 0.0074 0.1309 0.0993
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0065 0.111 0.111
Brugia malayi RhoGAP domain containing protein 0.0065 0.111 0.111
Loa Loa (eye worm) CAMK/CAMKL/CHK1 protein kinase 0.0494 1 1
Echinococcus granulosus serine:threonine protein kinase N2 0.0074 0.1309 0.1215
Brugia malayi Pleckstrin Homology Domain 0.0069 0.1192 0.1192
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.0071 0.1236 0.112
Loa Loa (eye worm) hypothetical protein 0.0268 0.5325 0.5325
Brugia malayi Variant SH3 domain containing protein 0.0065 0.111 0.111
Echinococcus multilocularis Rac GTPase activating protein 1 0.0065 0.111 0.0954
Echinococcus granulosus RNA directed DNA polymerase 0.0115 0.2152 0.2322
Loa Loa (eye worm) Ras association domain family 1 isoform A 0.0065 0.111 0.111
Loa Loa (eye worm) AGC/PKN protein kinase 0.0074 0.1309 0.1309
Trichomonas vaginalis AGC family protein kinase 0.0078 0.1391 1
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0065 0.111 0.0787
Brugia malayi p70 ribosomal S6 kinase beta 0.0074 0.1309 0.1309
Loa Loa (eye worm) hypothetical protein 0.0183 0.3559 0.3559
Echinococcus granulosus protein kinase c epsilon type 0.0279 0.5549 0.6782
Echinococcus multilocularis dnaJ subfamily B 0.0398 0.8 1
Echinococcus granulosus protein kinase C gamma type 0.0195 0.3815 0.4505
Schistosoma mansoni atypical protein kinase C 0.0225 0.4426 0.4224
Loa Loa (eye worm) hypothetical protein 0.0065 0.111 0.111
Leishmania major serine/threonine-protein kinase, putative,protein kinase, putative 0.0171 0.3305 0.5
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0279 0.5549 0.5549
Echinococcus granulosus unc 13 munc13 0.0071 0.1236 0.112
Schistosoma mansoni serine/threonine protein kinase 0.0065 0.111 0.0787
Echinococcus multilocularis RNA directed DNA polymerase 0.0115 0.2152 0.2322
Schistosoma mansoni cpg binding protein 0.003 0.0383 0.0034
Echinococcus granulosus NDR protein kinase 0.0074 0.1309 0.1215
Loa Loa (eye worm) raf kinase 0.0065 0.111 0.111
Entamoeba histolytica diacylglycerol kinase, putative 0.0065 0.111 0.4045
Schistosoma mansoni serine/threonine protein kinase 0.026 0.5152 0.4976
Onchocerca volvulus 0.0071 0.1236 0.1424
Brugia malayi RhoGAP domain containing protein 0.0065 0.111 0.111
Trichomonas vaginalis AGC family protein kinase 0.0074 0.1309 0.5622
Toxoplasma gondii diacylglycerol kinase, putative 0.0065 0.111 0.5501
Echinococcus granulosus Protein kinase C brain isozyme 0.026 0.5152 0.6261
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.0074 0.1309 0.1215
Schistosoma mansoni protein kinase C 0.0071 0.1236 0.0918
Schistosoma mansoni serine/threonine protein kinase 0.0494 1 1
Trichomonas vaginalis AGC family protein kinase 0.0078 0.1391 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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