Detailed information for compound 645340

Basic information

Technical information
  • TDR Targets ID: 645340
  • Name: N-[(4-chlorophenyl)methyl]-N-[4-(4-methylpipe ridine-1-carbonyl)phenyl]methanesulfonamide
  • MW: 420.953 | Formula: C21H25ClN2O3S
  • H donors: 0 H acceptors: 3 LogP: 3.93 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC1CCN(CC1)C(=O)c1ccc(cc1)N(S(=O)(=O)C)Cc1ccc(cc1)Cl
  • InChi: 1S/C21H25ClN2O3S/c1-16-11-13-23(14-12-16)21(25)18-5-9-20(10-6-18)24(28(2,26)27)15-17-3-7-19(22)8-4-17/h3-10,16H,11-15H2,1-2H3
  • InChiKey: XQAGASZSKFDHBS-UHFFFAOYSA-N  

Network

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Synonyms

  • N-[(4-chlorophenyl)methyl]-N-[4-[(4-methyl-1-piperidinyl)-oxomethyl]phenyl]methanesulfonamide
  • N-(4-chlorobenzyl)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide
  • N-[(4-chlorophenyl)methyl]-N-[4-(4-methylpiperidin-1-yl)carbonylphenyl]methanesulfonamide
  • Oprea1_035393
  • Oprea1_163237
  • ZINC00853216

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
Loa Loa (eye worm) hypothetical protein 0.0103 0.3331 0.3246
Brugia malayi glucose-6-phosphate dehydrogenase 0.009 0.2742 0.2651
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0653 0.0754
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0653 0.0754
Brugia malayi MH2 domain containing protein 0.0116 0.3892 0.3815
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.6094 0.4333
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.6094 0.4333
Echinococcus granulosus geminin 0.0187 0.7128 1
Toxoplasma gondii glucose-6-phosphate 1-dehydrogenase 0.0099 0.3108 1
Echinococcus multilocularis glucose 6 phosphate 1 dehydrogenase 0.009 0.2742 0.3738
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Giardia lamblia Glucose-6-phosphate 1-dehydrogenase 0.0099 0.3108 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.6094 0.4333
Mycobacterium ulcerans glucose-6-phosphate 1-dehydrogenase 0.009 0.2742 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0103 0.3331 0.3246
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.6094 0.4333
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0653 0.0754
Brugia malayi photoreceptor-specific nuclear receptor 0.0239 0.9469 0.9462
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0251 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0653 0.0754
Leishmania major glucose-6-phosphate 1-dehydrogenase, putative 0.009 0.2742 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Mycobacterium tuberculosis Probable glucose-6-phosphate 1-dehydrogenase Zwf2 (G6PD) 0.0031 0.0064 0.5
Loa Loa (eye worm) glucose-6-phosphate dehydrogenase 0.009 0.2742 0.2651
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.0653 0.0535
Echinococcus multilocularis geminin 0.0187 0.7128 1
Trichomonas vaginalis glucosylceramidase, putative 0.0173 0.6495 0.4915
Plasmodium vivax glucose-6-phosphate 1-dehydrogenase, putative 0.0099 0.3108 0.5
Loa Loa (eye worm) hypothetical protein 0.0071 0.1847 0.1744
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.6094 0.4333
Treponema pallidum glucose-6-phosphate 1-dehydrogenase 0.009 0.2742 0.5
Trypanosoma brucei glucose-6-phosphate 1-dehydrogenase 0.009 0.2742 0.5
Schistosoma mansoni glucose-6-phosphate 1-dehydrogenase 0.009 0.2742 0.3738
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Schistosoma mansoni hypothetical protein 0.0071 0.1847 0.2459
Brugia malayi follicle stimulating hormone receptor 0.0225 0.8828 0.8813
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0653 0.0754
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0653 0.0754
Plasmodium falciparum glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase 0.0099 0.3108 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.0653 0.0535
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Schistosoma mansoni hypothetical protein 0.0187 0.7128 1
Trichomonas vaginalis glucosylceramidase, putative 0.0251 1 1
Onchocerca volvulus Glucosylceramidase homolog 0.0164 0.6094 0.5
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0225 0.8828 0.8813
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.3892 0.3815
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.3892 0.3815
Trypanosoma cruzi glucose-6-phosphate 1-dehydrogenase, putative 0.009 0.2742 1
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.6094 0.4333
Chlamydia trachomatis glucose-6-phosphate 1-dehydrogenase 0.009 0.2742 0.5
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0653 0.0754
Trichomonas vaginalis glucosylceramidase, putative 0.0164 0.6094 0.4333
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0103 0.3331 0.3246
Trichomonas vaginalis glucosylceramidase, putative 0.0173 0.6495 0.4915
Schistosoma mansoni hypothetical protein 0.0187 0.7128 1
Brugia malayi latrophilin 2 splice variant baaae 0.0071 0.1847 0.1744
Loa Loa (eye worm) hypothetical protein 0.0239 0.9469 0.9462
Echinococcus granulosus glucose 6 phosphate 1 dehydrogenase 0.009 0.2742 0.3738
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0103 0.3331 0.3246

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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