Detailed information for compound 648962

Basic information

Technical information
  • TDR Targets ID: 648962
  • Name: 2-[(4-bromophenyl)sulfonyl-cyclohexylamino]-N -methylacetamide
  • MW: 389.308 | Formula: C15H21BrN2O3S
  • H donors: 1 H acceptors: 3 LogP: 2.92 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CNC(=O)CN(S(=O)(=O)c1ccc(cc1)Br)C1CCCCC1
  • InChi: 1S/C15H21BrN2O3S/c1-17-15(19)11-18(13-5-3-2-4-6-13)22(20,21)14-9-7-12(16)8-10-14/h7-10,13H,2-6,11H2,1H3,(H,17,19)
  • InChiKey: OXHDNPYGVFURJG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[(4-bromophenyl)sulfonyl-cyclohexyl-amino]-N-methyl-acetamide
  • 2-[(4-bromophenyl)sulfonyl-cyclohexyl-amino]-N-methyl-ethanamide
  • STK151747
  • ZINC01178321

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 GPCR family 2 0.0016 0.0036 0.0036
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.002 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.002 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.002 0.0062 0.0062
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0036 0.0086
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0037 0.0086
Brugia malayi isocitrate dehydrogenase 0.0016 0.0037 0.0037
Echinococcus multilocularis cpg binding protein 0.0032 0.0134 0.0316
Loa Loa (eye worm) isocitrate dehydrogenase 0.0016 0.0037 0.0037
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.1886 0.5
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0076 0.0419 0.0384
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.002 0.0062 0.0062
Schistosoma mansoni RAR-like nuclear receptor 0.002 0.0062 0.0062
Schistosoma mansoni hypothetical protein 0.0341 0.2123 0.2123
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.002 0.0062 0.0062
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0304 0.1886 0.5
Echinococcus multilocularis microtubule associated protein 2 0.067 0.4242 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.002 0.0062 0.0145
Schistosoma mansoni hypothetical protein 0.0016 0.0036 0.0036
Echinococcus granulosus polycomb protein SCMH1 0.0048 0.0238 0.0238
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0076 0.0419 0.407
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.002 0.0062 0.0145
Schistosoma mansoni sex comb on midleg homolog 0.0048 0.0238 0.0238
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.002 0.0062 0.0062
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.1886 0.5
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0076 0.0419 0.0384
Toxoplasma gondii apocytochrome b, putative 0.1565 1 1
Echinococcus multilocularis polycomb protein SCMH1 0.0048 0.0238 0.0562
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.1886 0.5
Brugia malayi hypothetical protein 0.0237 0.1455 0.1455
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.1886 0.5
Loa Loa (eye worm) hypothetical protein 0.002 0.0062 0.0062
Brugia malayi mbt repeat family protein 0.0048 0.0238 0.0238
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0054 0.0281 0.0281
Schistosoma mansoni thyroid hormone receptor 0.002 0.0062 0.0062
Schistosoma mansoni cpg binding protein 0.003 0.0123 0.0123
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0054 0.0281 0.0281
Echinococcus multilocularis isocitrate dehydrogenase 0.0016 0.0037 0.0086
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0048 0.0238 0.9809
Schistosoma mansoni peptidase Clp (S14 family) 0.0076 0.0419 0.0419
Schistosoma mansoni cytochrome b 0.1565 1 1
Echinococcus multilocularis survival motor neuron protein 1 0.0237 0.1455 0.343
Schistosoma mansoni retinoic acid receptor RXR 0.002 0.0062 0.0062
Echinococcus multilocularis geminin 0.0341 0.2123 0.5005
Plasmodium vivax cytochrome b 0.1565 1 1
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0026 0.0099 0.0063
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0062 0.0062
Brugia malayi Nuclear hormone receptor family member nhr-41 0.002 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.002 0.0062 0.0062
Schistosoma mansoni retinoid-x-receptor (RXR) 0.002 0.0062 0.0062
Schistosoma mansoni hypothetical protein 0.0012 0.0007 0.0007
Schistosoma mansoni cytochrome b 0.1565 1 1
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0012 0.0007 0.0007
Schistosoma mansoni myelin transcription factor 1 myt1 0.0054 0.0281 0.0281
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0062 0.0062
Toxoplasma gondii cytochrome b 0.1565 1 1
Loa Loa (eye worm) cytochrome b 0.1565 1 1
Loa Loa (eye worm) hypothetical protein 0.0237 0.1455 0.1455
Brugia malayi Nuclear hormone receptor family member nhr-1 0.002 0.0062 0.0062
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.01 0.0063
Echinococcus multilocularis GPCR, family 2 0.0016 0.0036 0.0086
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0062 0.0062
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.002 0.0062 0.0062
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.002 0.0062 0.0062
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.005 0.0251 0.1931
Echinococcus granulosus SAM and MBT domain containing protein 0.0048 0.0238 0.0238
Onchocerca volvulus 0.0048 0.0242 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0036 0.0036
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0036 0.0036
Schistosoma mansoni cpg binding protein 0.0032 0.0134 0.0134
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 0.0419 0.0384
Loa Loa (eye worm) mbt repeat family protein 0.0048 0.0238 0.0238
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.002 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.002 0.0062 0.0062
Treponema pallidum fructose-bisphosphate aldolase 0.0304 0.1886 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.002 0.0062 0.0062
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.1886 0.5
Brugia malayi photoreceptor-specific nuclear receptor 0.002 0.0062 0.0062
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 0.0419 0.0384
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.1886 0.5
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0148 0.0886 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.0264 0.0264
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.002 0.0062 0.0062
Plasmodium falciparum cytochrome b 0.1565 1 1
Loa Loa (eye worm) MBCTL1 0.0054 0.0281 0.0281
Loa Loa (eye worm) hypothetical protein 0.002 0.0062 0.0062
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0076 0.0419 0.1792
Echinococcus granulosus retinoic acid receptor rxr beta a 0.002 0.0062 0.0062
Echinococcus granulosus geminin 0.0341 0.2123 0.2123
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 0.0419 0.5
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.1886 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.0264 0.0264
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.0264 0.0264
Echinococcus granulosus histone acetyltransferase MYST2 0.0054 0.0281 0.0281
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0054 0.0281 0.0662
Loa Loa (eye worm) hypothetical protein 0.0054 0.0281 0.0281
Loa Loa (eye worm) hypothetical protein 0.0052 0.0264 0.0264
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.002 0.0062 0.0062
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0062 0.0062
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.002 0.0062 0.0062
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0062 0.0062
Wolbachia endosymbiont of Brugia malayi cytochrome b subunit of the bc complex 0.1565 1 1
Echinococcus multilocularis FTZ F1 alpha 0.002 0.0062 0.0145
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0062 0.0062
Schistosoma mansoni hypothetical protein 0.0016 0.0036 0.0036
Echinococcus granulosus peptidase Clp S14 family 0.005 0.0251 0.0251
Brugia malayi Probable ClpP-like protease 0.0076 0.0419 0.0419
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0076 0.0419 0.0989
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0036 0.0086
Echinococcus multilocularis thyroid hormone receptor alpha 0.002 0.0062 0.0145
Brugia malayi hypothetical protein 0.0026 0.01 0.01
Echinococcus granulosus survival motor neuron protein 1 0.0237 0.1455 0.1455
Loa Loa (eye worm) steroid hormone receptor 0.002 0.0062 0.0062
Brugia malayi mbt repeat family protein 0.0048 0.0238 0.0238
Schistosoma mansoni nuclear hormone receptor 0.002 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0076 0.0419 0.0419
Brugia malayi nuclear receptor NHR-88 0.002 0.0062 0.0062
Brugia malayi CXXC zinc finger family protein 0.003 0.0123 0.0123
Echinococcus granulosus cytochrome B 0.1565 1 1
Schistosoma mansoni hypothetical protein 0.0341 0.2123 0.2123
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0016 0.0037 0.0037
Loa Loa (eye worm) CXXC zinc finger family protein 0.003 0.0123 0.0123
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0159 0.0159
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.002 0.0062 0.0062
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.002 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0026 0.01 0.01
Schistosoma mansoni sex comb on midleg homolog 0.0048 0.0238 0.0238
Brugia malayi Nuclear hormone receptor family member nhr-3 0.002 0.0062 0.0062
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0148 0.0886 1
Echinococcus multilocularis peptidase Clp (S14 family) 0.005 0.0251 0.0592
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0036 0.0036
Onchocerca volvulus 0.0048 0.0238 0.9809
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0062 0.0145
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0016 0.0037 0.0086
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.01 0.0063
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0062 0.0062
Brugia malayi steroid hormone receptor 0.002 0.0062 0.0062
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.005 0.0251 0.2526
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0188 0.1142 0.1142
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.002 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.002 0.0062 0.0062
Schistosoma mansoni hypothetical protein 0.0035 0.0159 0.0159
Loa Loa (eye worm) hypothetical protein 0.002 0.0062 0.0062
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0304 0.1886 0.5
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0036 0.0036
Schistosoma mansoni hypothetical protein 0.0016 0.0036 0.0036
Toxoplasma gondii hypothetical protein 0.0026 0.0099 0.0063
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 0.0419 0.5
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0026 0.0099 0.0063
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.002 0.0062 0.0145
Echinococcus granulosus dnaJ subfamily B 0.0425 0.2667 0.2667
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.005 0.0251 0.2526
Brugia malayi Nuclear hormone receptor family member nhr-49 0.002 0.0062 0.0062
Echinococcus multilocularis ecdysone induced protein 78C 0.002 0.0062 0.0145
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0063 0.0338 0.0338
Echinococcus multilocularis histone acetyltransferase MYST2 0.0054 0.0281 0.0662
Echinococcus multilocularis SAM and MBT domain containing protein 0.0048 0.0238 0.0562
Schistosoma mansoni microtubule-associated protein tau 0.067 0.4242 0.4242
Loa Loa (eye worm) hypothetical protein 0.0035 0.0159 0.0159
Echinococcus granulosus ecdysone induced protein 78C 0.002 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0048 0.0238 0.0238
Loa Loa (eye worm) hypothetical protein 0.0016 0.0036 0.0036
Onchocerca volvulus 0.003 0.0123 0.3408
Brugia malayi Nuclear hormone receptor family member nhr-14 0.002 0.0062 0.0062
Echinococcus multilocularis dnaJ subfamily B 0.0425 0.2667 0.6288
Schistosoma mansoni cpg binding protein 0.0032 0.0134 0.0134
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0304 0.1886 0.5
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0012 0.0007 0.0015
Schistosoma mansoni hypothetical protein 0.029 0.18 0.18
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.01 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0057 0.0295 0.0259
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0062 0.0062
Brugia malayi hypothetical protein 0.0017 0.004 0.004
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0036 0.0036
Brugia malayi ecdysteroid receptor 0.002 0.0062 0.0062
Schistosoma mansoni hypothetical protein 0.0048 0.0242 0.0242
Echinococcus granulosus FTZ F1 alpha 0.002 0.0062 0.0062
Brugia malayi Isocitrate dehydrogenase 0.0016 0.0037 0.0037
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0037 0.0086
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.01 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0062 0.0145
Schistosoma mansoni thyroid hormone receptor 0.002 0.0062 0.0062
Brugia malayi Nuclear hormone receptor family member nhr-31 0.002 0.0062 0.0062
Giardia lamblia Fructose-bisphosphate aldolase 0.0304 0.1886 0.5
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0048 0.0242 0.0242
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0076 0.0419 0.0419
Schistosoma mansoni survival motor neuron protein 0.0048 0.0242 0.0242
Brugia malayi Nuclear hormone receptor family member nhr-40 0.002 0.0062 0.0062
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0188 0.1142 0.2693
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.01 1
Brugia malayi nuclear hormone receptor 0.002 0.0062 0.0062
Schistosoma mansoni Tr4/Tr2 (homologue) 0.002 0.0062 0.0062
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.002 0.0062 0.0062
Schistosoma mansoni coup transcription factor 0.002 0.0062 0.0062
Echinococcus granulosus microtubule associated protein 2 0.067 0.4242 0.4242
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.002 0.0062 0.0145
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.01 0.0063
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0037 0.0086
Schistosoma mansoni hypothetical protein 0.0016 0.0036 0.0036
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.01 0.0063
Echinococcus granulosus cpg binding protein 0.0032 0.0134 0.0134
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0148 0.0886 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.002 0.0062 0.0062
Brugia malayi Nuclear hormone receptor-like 1 0.002 0.0062 0.0062
Schistosoma mansoni hypothetical protein 0.0425 0.2667 0.2667
Brugia malayi Steroid receptor seven-up type 2 0.002 0.0062 0.0062
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0016 0.0037 0.0037
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0048 0.0238 0.0238
Leishmania major hypothetical protein, conserved 0.0026 0.01 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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.