Detailed information for compound 1269157

Basic information

Technical information
  • TDR Targets ID: 1269157
  • Name: 5-chloro-N-(2-piperidin-1-ylphenyl)thiophene- 2-sulfonamide
  • MW: 356.891 | Formula: C15H17ClN2O2S2
  • H donors: 1 H acceptors: 2 LogP: 4.39 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(s1)S(=O)(=O)Nc1ccccc1N1CCCCC1
  • InChi: 1S/C15H17ClN2O2S2/c16-14-8-9-15(21-14)22(19,20)17-12-6-2-3-7-13(12)18-10-4-1-5-11-18/h2-3,6-9,17H,1,4-5,10-11H2
  • InChiKey: RXDWTDRPUXJDPY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 5-chloro-N-[2-(1-piperidyl)phenyl]thiophene-2-sulfonamide
  • 5-chloro-N-[2-(1-piperidyl)phenyl]-2-thiophenesulfonamide
  • 5-chloro-N-(2-piperidinophenyl)thiophene-2-sulfonamide
  • MLS000570381
  • SMR000150436
  • T5241132
  • ZINC02647919

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens polo-like kinase 1 Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific demethylase 4A Starlite/ChEMBL No references
Homo sapiens polymerase (DNA directed) iota Starlite/ChEMBL No references
Homo sapiens mucolipin 3 Starlite/ChEMBL No references
Homo sapiens chromobox homolog 1 Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni mucolipin Get druggable targets OG5_129484 All targets in OG5_129484
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma japonicum Chromobox protein homolog 5, putative Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus multilocularis mucolipin 3 Get druggable targets OG5_129484 All targets in OG5_129484
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Leishmania mexicana protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma mansoni mucolipin Get druggable targets OG5_129484 All targets in OG5_129484
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus multilocularis Transcription factor, JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Leishmania braziliensis protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Trypanosoma cruzi polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Theileria parva hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Loa Loa (eye worm) heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma cruzi polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Brugia malayi Heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Brugia malayi Coelomocyte uptake defective protein 5 Get druggable targets OG5_129484 All targets in OG5_129484
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma mansoni jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Candida albicans protein serine/threonine kinase Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus granulosus jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Onchocerca volvulus Serine\/threonine kinase homolog Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Candida albicans protein serine/threonine kinase Get druggable targets OG5_127396 All targets in OG5_127396
Onchocerca volvulus Heterochromatin protein 1 homolog Get druggable targets OG5_129545 All targets in OG5_129545
Brugia malayi serine/threonine-protein kinase plk-2 Get druggable targets OG5_127396 All targets in OG5_127396
Onchocerca volvulus Get druggable targets OG5_129545 All targets in OG5_129545
Giardia lamblia Kinase, PLK Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum ko:K04994 mucolipin 3, putative Get druggable targets OG5_129484 All targets in OG5_129484
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma congolense protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Loa Loa (eye worm) PLK/PLK1 protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum Serine/threonine-protein kinase PLK1, putative Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus granulosus mucolipin 3 Get druggable targets OG5_129484 All targets in OG5_129484
Leishmania infantum protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Loa Loa (eye worm) jmjC domain-containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Trypanosoma brucei gambiense polo-like protein kinase,protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Loa Loa (eye worm) mucolipin 1 Get druggable targets OG5_129484 All targets in OG5_129484
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum ko:K06631 polo-like kinase 1, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus granulosus serine:threonine protein kinase PLK1 Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma brucei polo-like protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum expressed protein Get druggable targets OG5_129484 All targets in OG5_129484
Echinococcus granulosus Transcription factor JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Entamoeba histolytica serine/threonine protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus multilocularis jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma japonicum JmjC domain-containing histone demethylation protein 3C, putative Get druggable targets OG5_127917 All targets in OG5_127917
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus multilocularis serine:threonine protein kinase PLK1 Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania major protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum Probable JmjC domain-containing histone demethylation protein 3B, putative Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Brugia malayi jmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Plasmodium yoelii hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Plasmodium falciparum phd finger protein, putative 0.0035 0.0222 0.5
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.9849 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.1126 0.0939
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0115 1 1
Brugia malayi chromobox protein homolog 3 0.0047 0.1681 0.1493
Entamoeba histolytica serine/threonine protein kinase, putative 0.0114 0.9849 0.5
Echinococcus multilocularis chromobox protein 1 0.0084 0.6195 0.6108
Trypanosoma cruzi polo-like protein kinase, putative 0.0114 0.9849 0.5
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0114 0.9849 0.5
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0114 0.9849 1
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0051 0.2118 0.197
Echinococcus granulosus mucolipin 3 0.0079 0.5537 0.5436
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.1126 0.0939
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0114 0.9849 0.9845
Schistosoma mansoni kinase 0.0058 0.3001 0.2887
Loa Loa (eye worm) mucolipin 1 0.0079 0.5537 0.5521
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.3273 0.3169
Echinococcus granulosus chromobox protein 1 0.0084 0.6195 0.6108
Echinococcus multilocularis mucolipin 3 0.0079 0.5537 0.5436
Onchocerca volvulus Serine\/threonine kinase homolog 0.0114 0.9849 1
Echinococcus multilocularis chromobox protein 1 0.0084 0.6195 0.6108
Echinococcus multilocularis lysine specific demethylase 5A 0.0043 0.1126 0.0925
Toxoplasma gondii PHD-finger domain-containing protein 0.0035 0.0222 0.5
Trichomonas vaginalis chromobox protein, putative 0.0051 0.2118 0.2151
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.3273 0.312
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.9849 1
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.9849 1
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0114 0.9849 0.9845
Echinococcus granulosus chromobox protein 1 0.0084 0.6195 0.6108
Echinococcus granulosus jumonji domain containing protein 0.0049 0.1905 0.1721
Schistosoma mansoni serine/threonine protein kinase 0.0114 0.9849 1
Schistosoma mansoni chromobox protein 0.0084 0.6195 0.6204
Echinococcus multilocularis jumonji domain containing protein 0.0049 0.1905 0.1721
Trypanosoma cruzi polo-like protein kinase, putative 0.0114 0.9849 0.5
Trichomonas vaginalis chromobox protein, putative 0.0051 0.2118 0.2151
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0222 0.5
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0047 0.1681 0.1516
Schistosoma mansoni mucolipin 0.0079 0.5537 0.5521
Giardia lamblia Kinase, PLK 0.0114 0.9849 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.3273 0.312
Loa Loa (eye worm) hypothetical protein 0.0047 0.1681 0.1516
Loa Loa (eye worm) hypothetical protein 0.0041 0.0947 0.0754
Echinococcus granulosus lysine specific demethylase 5A 0.0043 0.1126 0.0925
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.9849 1
Schistosoma mansoni hypothetical protein 0.0041 0.0947 0.0754
Brugia malayi serine/threonine-protein kinase plk-2 0.0114 0.9849 0.9845
Trichomonas vaginalis CAMK family protein kinase 0.0056 0.2817 0.286
Trichomonas vaginalis CAMK family protein kinase 0.0056 0.2817 0.286
Trichomonas vaginalis chromobox protein, putative 0.0084 0.6195 0.629
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.9849 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0437 0.0224
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0947 0.0742
Trichomonas vaginalis chromobox protein, putative 0.0084 0.6195 0.629
Schistosoma mansoni jumonji domain containing protein 0.0092 0.7107 0.7152
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.9849 1
Loa Loa (eye worm) hypothetical protein 0.006 0.3273 0.3169
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.1681 0.1707
Onchocerca volvulus 0.0037 0.0437 0.0224
Schistosoma mansoni mucolipin 0.0072 0.4733 0.4686
Loa Loa (eye worm) jmjC domain-containing protein 0.0073 0.4798 0.4754
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0115 1 1
Brugia malayi jmjC domain containing protein 0.0043 0.1126 0.0925
Brugia malayi Heterochromatin protein 1 0.0084 0.6195 0.6108
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.1681 0.1707
Loa Loa (eye worm) hypothetical protein 0.006 0.3292 0.3189
Loa Loa (eye worm) heterochromatin protein 1 0.0084 0.6195 0.6204
Trypanosoma brucei polo-like protein kinase 0.0114 0.9849 0.5
Toxoplasma gondii PHD-finger domain-containing protein 0.0035 0.0222 0.5
Schistosoma mansoni chromobox protein 0.0084 0.6195 0.6204
Brugia malayi Coelomocyte uptake defective protein 5 0.0079 0.5537 0.5436
Loa Loa (eye worm) jmjC domain-containing protein 0.0043 0.1126 0.0939
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.9849 1

Activities

Activity type Activity value Assay description Source Reference
EC50 = 0.62 um PUBCHEM_BIOASSAY: Late stage results from the probe development efforts to identify agonists of the Transient Receptor Potential Channels 3 and 2 (TRPML3 and TRPML2). (Class of assay: screening) [Related pubchem assays (depositor defined):AID1448, AID1525, AID1526, AID1562, AID1682, AID1809] Panel member name: TRPML3 Dose Response ChEMBL. No reference
EC50 (functional) = 0.872 um PUBCHEM_BIOASSAY: Dose response cell-based high-throughput screening assay for agonists of the transient receptor potential channel ML3 (TRPML3). (Class of assay: confirmatory) [Related pubchem assays: 1526, 1424, 1448 ] ChEMBL. No reference
EC50 (functional) > 29.9 um PUBCHEM_BIOASSAY: Fluorescence counterscreen assay for TRPML3 agonists: dose response cell-based high-throughput screening assay to identify agonists of the transient receptor potential channel N1 (TRPN1). (Class of assay: confirmatory) [Related pubchem assays: 1526, 1424, 1448 ] ChEMBL. No reference
EC50 > 29.9 um PUBCHEM_BIOASSAY: Late stage results from the probe development efforts to identify agonists of the Transient Receptor Potential Channels 3 and 2 (TRPML3 and TRPML2). (Class of assay: screening) [Related pubchem assays (depositor defined):AID1448, AID1525, AID1526, AID1562, AID1682, AID1809] Panel member name: TRPN1 Dose Response ChEMBL. No reference
Potency (functional) 0.7079 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 2.9935 uM PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.5481 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 7.0795 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.1189 uM PubChem BioAssay. qHTS of Trypanosoma Brucei Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 28.1838 uM PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS for Inhibitors of Glutaminase (GLS). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) = 44.6684 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 44.6684 uM PubChem BioAssay. Inhibitors of USP1/UAF1: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PubChem BioAssay. qHTS for Inhibitors of WRN Helicase. (Class of assay: confirmatory) ChEMBL. No reference

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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