Detailed information for compound 800578

Basic information

Technical information
  • TDR Targets ID: 800578
  • Name: 1-(2-ethylsulfonylethyl)piperidine
  • MW: 205.318 | Formula: C9H19NO2S
  • H donors: 0 H acceptors: 2 LogP: 0.85 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCS(=O)(=O)CCN1CCCCC1
  • InChi: 1S/C9H19NO2S/c1-2-13(11,12)9-8-10-6-4-3-5-7-10/h2-9H2,1H3
  • InChiKey: XXWMLROCVKLNOU-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • Oprea1_165742
  • 1-(2-Ethanesulfonyl-ethyl)-piperidine
  • BAS 00392694
  • Oprea1_116688
  • ZERO/005701

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 uncharacterized sodium dependent transporter 0.0098 0.0915 0.0915
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0058 0.0385 0.5
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.0098 0.0915 1
Treponema pallidum sodium- and chloride- dependent transporter 0.0576 0.7245 1
Brugia malayi hypothetical protein 0.0226 0.2611 0.2594
Brugia malayi aryl hydrocarbon receptor AHR-1 0.0039 0.0131 0.0108
Trypanosoma cruzi ISWI complex protein 0.0049 0.0269 0.6883
Loa Loa (eye worm) hypothetical protein 0.0061 0.0429 0.0415
Trichomonas vaginalis ap endonuclease, putative 0.0058 0.0385 0.135
Toxoplasma gondii PHD-finger domain-containing protein 0.0061 0.0429 0.4555
Brugia malayi Helix-loop-helix DNA-binding domain containing protein 0.0039 0.0138 0.0115
Echinococcus multilocularis transfer RNA-Lys 0.0038 0.0119 0.0097
Plasmodium vivax hypothetical protein, conserved 0.0061 0.0429 0.4555
Loa Loa (eye worm) helix-loop-helix DNA-binding domain-containing protein 0.0039 0.0138 0.0123
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0058 0.0385 0.4058
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0066 0.0498 0.0476
Loa Loa (eye worm) hypothetical protein 0.0098 0.0915 0.0901
Echinococcus granulosus fetal alzheimer antigen falz 0.0074 0.0598 0.0598
Onchocerca volvulus 0.0098 0.0915 0.1235
Loa Loa (eye worm) hypothetical protein 0.0209 0.2393 0.2382
Echinococcus multilocularis peregrin 0.0069 0.0529 0.0508
Schistosoma mansoni jumonji/arid domain-containing protein 0.0082 0.0702 0.094
Echinococcus multilocularis Aryl hydrocarbon receptor nuclear 0.008 0.068 0.0659
Schistosoma mansoni hypothetical protein 0.0143 0.1516 0.2067
Mycobacterium leprae Possible regulatory protein 0.003 0.0015 0.5
Brugia malayi hypothetical protein 0.0039 0.0131 0.0108
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0058 0.0385 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0062 0.0439 0.0576
Echinococcus multilocularis GPCR, family 2 0.0066 0.0498 0.0476
Plasmodium vivax hypothetical protein, conserved 0.0098 0.0915 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0085 0.0746 0.0746
Loa Loa (eye worm) hypothetical protein 0.0039 0.0131 0.0116
Schistosoma mansoni sodium/chloride dependent transporter 0.0098 0.0915 0.1235
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0209 0.2393 0.2376
Echinococcus multilocularis muscleblind protein 0.0784 1 1
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0576 0.7245 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0224 0.0279
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0193 0.2174 0.2174
Onchocerca volvulus 0.0098 0.0915 0.1235
Plasmodium vivax amine transporter, putative 0.0098 0.0915 1
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0098 0.0915 1
Echinococcus granulosus cpg binding protein 0.0036 0.0102 0.0102
Schistosoma mansoni sodium-dependent amino acid transporter 0.0098 0.0915 0.1235
Echinococcus multilocularis jumonji domain containing protein 0.0085 0.0746 0.0725
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0066 0.0498 0.0498
Loa Loa (eye worm) hypothetical protein 0.0098 0.0915 0.0901
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0077 0.0642 0.0621
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.02 0.2269 0.2269
Brugia malayi hypothetical protein 0.0039 0.0138 0.0115
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0209 0.2393 0.2382
Onchocerca volvulus Alhambra homolog 0.0061 0.0429 0.0563
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0098 0.0915 0.1235
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0224 0.0224
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0066 0.0498 0.0498
Echinococcus granulosus geminin 0.0169 0.1857 0.1857
Entamoeba histolytica hypothetical protein 0.0077 0.0642 1
Onchocerca volvulus 0.0038 0.0127 0.0144
Loa Loa (eye worm) PHD-finger family protein 0.0066 0.0496 0.0482
Brugia malayi hypothetical protein 0.0077 0.0642 0.0621
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0058 0.0385 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0085 0.0746 0.1002
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.02 0.2269 0.2251
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0098 0.0915 0.0894
Entamoeba histolytica hypothetical protein 0.0077 0.0642 1
Brugia malayi jmjC domain containing protein 0.0082 0.0702 0.0681
Loa Loa (eye worm) transcription factor SMAD2 0.0125 0.1276 0.1263
Loa Loa (eye worm) hypothetical protein 0.0098 0.0915 0.0901
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0098 0.0915 1
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0098 0.0915 0.0915
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0224 0.0202
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0098 0.0915 0.0901
Echinococcus granulosus methyl CpG binding domain protein 2 0.0055 0.0344 0.0344
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0058 0.0385 1
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0098 0.0915 0.0915
Loa Loa (eye worm) hypothetical protein 0.0576 0.7245 0.7241
Schistosoma mansoni cpg binding protein 0.0036 0.0102 0.011
Plasmodium falciparum transporter, putative 0.0098 0.0915 1
Loa Loa (eye worm) hypothetical protein 0.0123 0.1248 0.1235
Brugia malayi aryl hydrocarbon receptor nuclear translocator protein, putative 0.0089 0.0796 0.0775
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0098 0.0915 0.1235
Echinococcus granulosus aryl hydrocarbon receptor 0.0069 0.0532 0.0532
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0115 0.1145 0.1124
Loa Loa (eye worm) bromodomain containing protein 0.0057 0.037 0.0356
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0061 0.0429 0.0563
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0074 0.0598 0.0577
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0098 0.0915 1
Schistosoma mansoni hypothetical protein 0.0408 0.502 0.6919
Brugia malayi Bromodomain containing protein 0.0069 0.0529 0.0508
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0098 0.0915 0.0894
Brugia malayi Pre-SET motif family protein 0.0208 0.2376 0.2359
Echinococcus multilocularis geminin 0.0169 0.1857 0.1839
Loa Loa (eye worm) hypothetical protein 0.0098 0.0915 0.0901
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0224 0.0202
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0098 0.0915 0.1235
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0224 0.021
Schistosoma mansoni jumonji/arid domain-containing protein 0.0082 0.0702 0.094
Loa Loa (eye worm) aryl Hydrocarbon receptor Associated protein family member 0.0119 0.1191 0.1178
Loa Loa (eye worm) hypothetical protein 0.0039 0.0131 0.0116
Loa Loa (eye worm) hypothetical protein 0.0066 0.0498 0.0484
Echinococcus granulosus single minded 2 0.0038 0.0119 0.0119
Loa Loa (eye worm) serotonin transporter b 0.0576 0.7245 0.7241
Brugia malayi PAS domain containing protein 0.0067 0.0513 0.0492
Loa Loa (eye worm) hypoxia-induced factor 1 0.0158 0.1707 0.1695
Echinococcus multilocularis sodium and chloride dependent glycine 0.0098 0.0915 0.0894
Brugia malayi exodeoxyribonuclease III family protein 0.0058 0.0385 0.0363
Onchocerca volvulus 0.0068 0.0525 0.0695
Entamoeba histolytica hypothetical protein 0.0077 0.0642 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0058 0.0385 0.0385
Schistosoma mansoni hypothetical protein 0.0169 0.1857 0.254
Loa Loa (eye worm) hypothetical protein 0.0105 0.1007 0.0994
Trichomonas vaginalis ap endonuclease, putative 0.0058 0.0385 0.135
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0074 0.0598 0.0797
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0066 0.0498 0.0476
Trypanosoma cruzi ISWI complex protein 0.0049 0.0269 0.6883
Schistosoma mansoni hypothetical protein 0.0049 0.0269 0.0341
Loa Loa (eye worm) hypothetical protein 0.0098 0.0915 0.0901
Toxoplasma gondii hypothetical protein 0.0098 0.0915 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0055 0.0344 0.0444
Brugia malayi hypothetical protein 0.0098 0.0915 0.0894
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0058 0.0385 0.0363
Loa Loa (eye worm) hypothetical protein 0.0098 0.0915 0.0901
Toxoplasma gondii hypothetical protein 0.0098 0.0915 1
Brugia malayi F/Y-rich N-terminus family protein 0.0036 0.0096 0.0073
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0224 0.0202
Brugia malayi Calcitonin receptor-like protein seb-1 0.0209 0.2393 0.2376
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0066 0.0498 0.0476
Echinococcus granulosus lysine specific demethylase 5A 0.0082 0.0702 0.0702
Plasmodium falciparum phd finger protein, putative 0.0061 0.0429 0.0835
Echinococcus multilocularis PHD finger protein rhinoceros 0.0061 0.0429 0.0407
Echinococcus multilocularis serotonin transporter 0.0576 0.7245 0.7239
Toxoplasma gondii exonuclease III APE 0.0058 0.0385 0.4058
Schistosoma mansoni hypothetical protein 0.0061 0.0429 0.0563
Brugia malayi Bromodomain containing protein 0.0123 0.1245 0.1225
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0098 0.0915 0.1235
Echinococcus granulosus serotonin transporter 0.0576 0.7245 0.7245
Schistosoma mansoni hypothetical protein 0.0066 0.0498 0.0658
Onchocerca volvulus 0.0576 0.7245 1
Schistosoma mansoni jumonji domain containing protein 0.0159 0.1724 0.2356
Brugia malayi MH2 domain containing protein 0.0125 0.1276 0.1256
Loa Loa (eye worm) PHD-finger family protein 0.0061 0.0429 0.0415
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0098 0.0915 0.0894
Toxoplasma gondii histone lysine methyltransferase SET1 0.0063 0.0454 0.483
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0098 0.0915 0.0894
Loa Loa (eye worm) hypothetical protein 0.0226 0.2611 0.26
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0224 0.0279
Brugia malayi PHD-finger family protein 0.0061 0.0429 0.0407
Echinococcus granulosus muscleblind protein 0.0784 1 1
Brugia malayi jmjC domain containing protein 0.02 0.2269 0.2251
Onchocerca volvulus Protein cycle homolog 0.0039 0.0138 0.0159
Schistosoma mansoni single-minded 0.0067 0.0513 0.0679
Schistosoma mansoni hypothetical protein 0.0066 0.0498 0.0658
Schistosoma mansoni zinc finger protein 0.0049 0.0269 0.0341
Echinococcus multilocularis muscleblind protein 1 0.0784 1 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0115 0.1145 0.1145
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0208 0.2376 0.2365
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0058 0.0385 0.5
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0098 0.0915 0.0894
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0085 0.0746 0.1002
Brugia malayi Latrophilin receptor protein 2 0.0066 0.0498 0.0476
Leishmania major hypothetical protein, conserved 0.0049 0.0269 0.6883
Schistosoma mansoni hypothetical protein 0.0077 0.0642 0.0858
Brugia malayi hypoxia-induced factor 1 0.0158 0.1707 0.1688
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0058 0.0385 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0576 0.7245 0.7239
Toxoplasma gondii PHD-finger domain-containing protein 0.0061 0.0429 0.4555
Schistosoma mansoni aryl hydrocarbon receptor nuclear translocator homolog (darnt) 0.0089 0.0796 0.1071
Schistosoma mansoni ap endonuclease 0.0058 0.0385 0.0501
Loa Loa (eye worm) hypothetical protein 0.0039 0.0131 0.0116
Entamoeba histolytica hypothetical protein 0.0077 0.0642 1
Echinococcus granulosus sodium and chloride dependent glycine 0.0098 0.0915 0.0915
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0098 0.0915 0.1235
Loa Loa (eye worm) jmjC domain-containing protein 0.0126 0.129 0.1277
Schistosoma mansoni cpg binding protein 0.0036 0.0102 0.011
Schistosoma mansoni bromodomain containing protein 0.0204 0.2326 0.319
Schistosoma mansoni zinc finger protein 0.0064 0.0472 0.0623
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0224 0.0224
Schistosoma mansoni ap endonuclease 0.0058 0.0385 0.0501
Loa Loa (eye worm) hypothetical protein 0.0085 0.0746 0.0733
Echinococcus granulosus peregrin 0.0069 0.0529 0.0529
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0224 0.0279
Loa Loa (eye worm) hypothetical protein 0.0784 1 1
Echinococcus granulosus PHD finger protein rhinoceros 0.0061 0.0429 0.0429
Schistosoma mansoni sodium/chloride dependent transporter 0.0098 0.0915 0.1235
Loa Loa (eye worm) hypothetical protein 0.0576 0.7245 0.7241
Loa Loa (eye worm) MH2 domain-containing protein 0.0125 0.1276 0.1263
Loa Loa (eye worm) latrophilin receptor protein 2 0.0066 0.0498 0.0484
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0193 0.2174 0.2157
Brugia malayi Bromodomain containing protein 0.0242 0.2823 0.2807
Echinococcus multilocularis aryl hydrocarbon receptor 0.0069 0.0532 0.051
Loa Loa (eye worm) hypothetical protein 0.0131 0.1348 0.1336
Schistosoma mansoni transcription factor LCR-F1 0.0077 0.0642 0.0858
Giardia lamblia PHD finger protein 15 0.0061 0.0429 1
Schistosoma mansoni aryl hydrocarbon receptor 0.0068 0.0521 0.0689
Echinococcus multilocularis sodium and chloride dependent glycine 0.0098 0.0915 0.0894
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0098 0.0915 0.0901
Echinococcus granulosus zinc finger protein 0.0064 0.0472 0.0472
Onchocerca volvulus 0.0237 0.2756 0.3784
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0098 0.0915 0.0894
Echinococcus multilocularis lysine specific demethylase 5A 0.0074 0.0599 0.0578
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0077 0.0642 0.0642
Echinococcus multilocularis dnaJ subfamily B 0.0408 0.502 0.5009
Loa Loa (eye worm) hypothetical protein 0.0098 0.0915 0.0901
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0058 0.0385 0.0371
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0098 0.0915 0.1235
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0098 0.0915 0.1235
Onchocerca volvulus 0.0098 0.0915 0.1235
Loa Loa (eye worm) solute carrier family 6 member 4 0.0576 0.7245 0.7241
Schistosoma mansoni hypothetical protein 0.0066 0.0498 0.0658
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0098 0.0915 0.0894
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0098 0.0915 0.0915
Schistosoma mansoni methyl-cpg binding protein mbd 0.0055 0.0344 0.0444
Echinococcus granulosus GPCR family 2 0.0066 0.0498 0.0498
Loa Loa (eye worm) hypothetical protein 0.0039 0.0131 0.0116
Loa Loa (eye worm) norepinephrine transporter 0.0576 0.7245 0.7241
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0055 0.0344 0.0322
Echinococcus multilocularis cpg binding protein 0.0036 0.0102 0.008
Schistosoma mansoni hypothetical protein 0.0066 0.0498 0.0658
Loa Loa (eye worm) hypothetical protein 0.0784 1 1
Trichomonas vaginalis set domain proteins, putative 0.0237 0.2756 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0058 0.0385 1
Loa Loa (eye worm) hypothetical protein 0.0227 0.262 0.261
Schistosoma mansoni hypothetical protein 0.0066 0.0496 0.0655
Echinococcus granulosus dnaJ subfamily B 0.0408 0.502 0.502
Schistosoma mansoni sodium/chloride dependent transporter 0.0576 0.7245 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0082 0.0702 0.0688
Brugia malayi latrophilin 2 splice variant baaae 0.0143 0.1516 0.1496
Echinococcus granulosus sodium and chloride dependent glycine 0.0098 0.0915 0.0915
Echinococcus granulosus Aryl hydrocarbon receptor nuclear 0.008 0.068 0.068
Brugia malayi bHLH-PAS transcription factor 0.0038 0.0119 0.0097
Brugia malayi PHD-finger family protein 0.0081 0.0699 0.0677
Loa Loa (eye worm) hypothetical protein 0.0143 0.1516 0.1503
Loa Loa (eye worm) hypothetical protein 0.0576 0.7245 0.7241
Loa Loa (eye worm) hypothetical protein 0.0138 0.1451 0.1439
Schistosoma mansoni hypothetical protein 0.0169 0.1857 0.254
Plasmodium falciparum amino acid transporter, putative 0.0098 0.0915 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0098 0.0915 0.1235
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0085 0.0746 0.0725
Echinococcus multilocularis zinc finger protein 0.0064 0.0472 0.0451
Echinococcus granulosus jumonji domain containing protein 0.0085 0.0746 0.0746

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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