Detailed information for compound 1391618

Basic information

Technical information
  • TDR Targets ID: 1391618
  • Name: N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylp henyl)pyrazine-2-carboxamide
  • MW: 433.481 | Formula: C19H23N5O5S
  • H donors: 1 H acceptors: 5 LogP: -0.53 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1cnccn1)Nc1cc(ccc1N1CCOCC1)S(=O)(=O)N1CCOCC1
  • InChi: 1S/C19H23N5O5S/c25-19(17-14-20-3-4-21-17)22-16-13-15(30(26,27)24-7-11-29-12-8-24)1-2-18(16)23-5-9-28-10-6-23/h1-4,13-14H,5-12H2,(H,22,25)
  • InChiKey: OMBRJVZHQIFKHY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(2-morpholino-5-morpholinosulfonyl-phenyl)pyrazine-2-carboxamide
  • N-(2-morpholino-5-morpholinosulfonylphenyl)-2-pyrazinecarboxamide
  • N-(2-morpholino-5-morpholinosulfonyl-phenyl)pyrazinamide
  • N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)pyrazine-2-carboxamide
  • T5222746
  • MLS000393791
  • SMR000247876

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references

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 multilocularis nuclear receptor 2DBD gamma 0.0006 0.0158 0.0583
Echinococcus granulosus FTZ F1 alpha 0.0012 0.0693 0.2558
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0012 0.0693 0.0693
Loa Loa (eye worm) hypothetical protein 0.0006 0.0215 0.0215
Onchocerca volvulus 0.0006 0.0158 0.0158
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0012 0.0693 0.1441
Loa Loa (eye worm) hypothetical protein 0.0124 1 1
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Brugia malayi hypothetical protein 0.0037 0.2711 0.2711
Brugia malayi CXXC zinc finger family protein 0.0029 0.2099 0.2099
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0012 0.0693 0.0693
Brugia malayi photoreceptor-specific nuclear receptor 0.0012 0.0693 0.0693
Echinococcus multilocularis FTZ F1 alpha 0.0012 0.0693 0.2558
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0006 0.0158 0.0158
Echinococcus granulosus cpg binding protein 0.0031 0.2237 0.8253
Schistosoma mansoni nuclear receptor 0.0006 0.0158 0.0329
Entamoeba histolytica hypothetical protein 0.0037 0.2711 1
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0006 0.0158 0.0329
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0012 0.0693 0.1441
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0228 0.1806
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0012 0.0693 0.0693
Brugia malayi orphan nuclear receptor NR2E1 0.0006 0.0158 0.0158
Schistosoma mansoni retinoic acid receptor RXR 0.0012 0.0693 0.1441
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0006 0.0215 0.0448
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0228 0.1806
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0012 0.0693 0.0693
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0419 0.0419
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0006 0.0158 0.0329
Onchocerca volvulus Protein ultraspiracle homolog 0.0012 0.0693 0.0693
Brugia malayi Nuclear hormone receptor-like 1 0.0006 0.0215 0.0215
Schistosoma mansoni ap endonuclease 0.0019 0.1264 0.2628
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.1264 1
Brugia malayi Nuclear hormone receptor-like 1 0.0006 0.0215 0.0215
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0006 0.0215 0.0795
Entamoeba histolytica hypothetical protein 0.0037 0.2711 1
Onchocerca volvulus 0.0012 0.0693 0.0693
Loa Loa (eye worm) steroid hormone receptor 0.0012 0.0693 0.0693
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.1264 0.5
Schistosoma mansoni nuclear receptor 0.0006 0.0158 0.0329
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0012 0.0693 0.0693
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0228 0.1806
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.2711 1
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0693 0.0693
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0228 0.1806
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.2099 0.2099
Loa Loa (eye worm) hypothetical protein 0.0012 0.0693 0.0693
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0012 0.0693 0.0693
Loa Loa (eye worm) hypothetical protein 0.0124 1 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0004 0.0027 0.0056
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.2711 0.5634
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0012 0.0693 0.0693
Schistosoma mansoni nuclear hormone receptor 0.0012 0.0693 0.1441
Loa Loa (eye worm) hypothetical protein 0.0012 0.0693 0.0693
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.1264 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0012 0.0693 0.0693
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0012 0.0693 0.0693
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0012 0.0693 0.0693
Toxoplasma gondii exonuclease III APE 0.0019 0.1264 0.2966
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0012 0.0693 0.2558
Echinococcus granulosus nuclear receptor nhr 48 0.0006 0.0158 0.0583
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0006 0.0158 0.0158
Schistosoma mansoni zinc finger protein 0.0006 0.0158 0.0329
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Loa Loa (eye worm) hypothetical protein 0.0012 0.0693 0.0693
Entamoeba histolytica hypothetical protein 0.0037 0.2711 1
Brugia malayi nuclear receptor NHR-88 0.0012 0.0693 0.0693
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.1264 0.1264
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0228 0.1806
Brugia malayi tailless protein 0.0006 0.0158 0.0158
Brugia malayi hypothetical protein 0.0006 0.0158 0.0158
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0012 0.0693 0.1441
Brugia malayi nuclear receptor RXR 0.0006 0.0215 0.0215
Onchocerca volvulus Bile acid receptor homolog 0.0012 0.0693 0.0693
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0012 0.0693 0.0693
Brugia malayi hypothetical protein 0.0006 0.0215 0.0215
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0228 0.1806
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0006 0.0158 0.0583
Loa Loa (eye worm) hypothetical protein 0.0012 0.0693 0.0693
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0012 0.0693 0.2558
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0228 0.1806
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0012 0.0693 0.1441
Loa Loa (eye worm) hypothetical protein 0.0006 0.0215 0.0215
Echinococcus granulosus ecdysone induced protein 78C 0.0012 0.0693 0.2558
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0006 0.0158 0.0158
Brugia malayi nuclear receptor RXR 0.0006 0.0158 0.0158
Loa Loa (eye worm) hypothetical protein 0.0012 0.0693 0.0693
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0006 0.0158 0.0583
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0012 0.0693 0.0693
Schistosoma mansoni RAR-like nuclear receptor 0.0012 0.0693 0.1441
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0012 0.0693 0.0693
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.1264 1
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0228 0.1806
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.1264 1
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.0281 0.1037
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0693 0.0693
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0228 0.1806
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0693 0.0693
Brugia malayi ecdysteroid receptor 0.0012 0.0693 0.0693
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.4263 1
Schistosoma mansoni nuclear receptor nhr-48 0.0006 0.0158 0.0329
Loa Loa (eye worm) hypothetical protein 0.0012 0.0693 0.0693
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0012 0.0693 0.2558
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.2711 1
Echinococcus multilocularis nuclear receptor nhr 48 0.0006 0.0158 0.0583
Loa Loa (eye worm) nuclear receptor NHR-67 0.0006 0.0158 0.0158
Echinococcus granulosus Nuclear hormone receptor HR96 0.0006 0.0158 0.0583
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0693 0.0693
Brugia malayi Steroid receptor seven-up type 2 0.0012 0.0693 0.0693
Brugia malayi Nuclear hormone receptor E75 0.0006 0.0158 0.0158
Entamoeba histolytica hypothetical protein 0.0037 0.2711 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.1264 0.4664
Schistosoma mansoni cpg binding protein 0.0029 0.2099 0.4363
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0006 0.0158 0.0583
Loa Loa (eye worm) hypothetical protein 0.0006 0.0215 0.0215
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.1264 0.4664
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Brugia malayi hypothetical protein 0.0006 0.0158 0.0158
Brugia malayi nuclear hormone receptor family member odr-7 0.0006 0.0158 0.0158
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0006 0.0158 0.0583
Brugia malayi nuclear receptor NHR-67 0.0006 0.0158 0.0158
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0693 0.0693
Brugia malayi nuclear hormone receptor 0.0012 0.0693 0.0693
Schistosoma mansoni steroid hormone receptor ad4bp 0.0012 0.0693 0.1441
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.1264 0.5
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.0281 0.1037
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0228 0.1806
Brugia malayi Nuclear hormone receptor E75 0.0006 0.0158 0.0158
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.0281 0.1037
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.0281 0.1037
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0693 0.2558
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0693 0.2558
Echinococcus multilocularis thyroid hormone receptor alpha 0.0012 0.0693 0.2558
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0012 0.0693 0.2558
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0012 0.0693 0.2558
Schistosoma mansoni hypothetical protein 0.0037 0.2711 0.5634
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0006 0.0215 0.0215
Onchocerca volvulus 0.0006 0.0158 0.0158
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.1264 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0281 0.0584
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0062 0.4812 1
Schistosoma mansoni cpg binding protein 0.0031 0.2237 0.465
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0019 0.1264 0.4664
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Echinococcus multilocularis ecdysone induced protein 78C 0.0012 0.0693 0.2558
Brugia malayi hypothetical protein 0.0006 0.0215 0.0215
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0012 0.0693 0.2558
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0006 0.0215 0.0448
Loa Loa (eye worm) DR-78 0.0006 0.0158 0.0158
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0228 0.1806
Onchocerca volvulus Huntingtin homolog 0.0124 1 1
Brugia malayi conserved hypotetical protein 0.0006 0.0158 0.0158
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0693 0.2558
Loa Loa (eye worm) hypothetical protein 0.0012 0.0693 0.0693
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0012 0.0693 0.2558
Loa Loa (eye worm) hypothetical protein 0.0012 0.0693 0.0693
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0006 0.0215 0.0215
Brugia malayi nuclear receptor NHR-88 0.0006 0.0158 0.0158
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0006 0.0158 0.0158
Schistosoma mansoni nuclear hormone receptor 0.0006 0.0158 0.0329
Echinococcus multilocularis cpg binding protein 0.0031 0.2237 0.8253
Echinococcus granulosus Nuclear hormone receptor HR96 0.0006 0.0158 0.0583
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.1264 1
Brugia malayi nuclear hormone receptor family member nhr-6 0.0006 0.0158 0.0158
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.1264 1
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0012 0.0693 0.2558
Brugia malayi ecdysone receptor 0.0006 0.0158 0.0158
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0012 0.0693 0.1441
Loa Loa (eye worm) hypothetical protein 0.0006 0.0215 0.0215
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.1264 0.1264
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0693 0.0693
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0012 0.0693 0.0693
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0693 0.1441
Loa Loa (eye worm) nuclear hormone receptor 0.0006 0.0158 0.0158
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0012 0.0693 0.2558
Schistosoma mansoni coup transcription factor 0.0012 0.0693 0.1441
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0228 0.1806
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0228 0.1806
Trichomonas vaginalis helicase, putative 0.0007 0.0228 0.1806
Schistosoma mansoni nuclear hormone receptor 0.0006 0.0158 0.0329
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0006 0.0215 0.0795
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0693 0.1441
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0006 0.0158 0.0583
Brugia malayi Nuclear hormone receptor-like 1 0.0012 0.0693 0.0693
Echinococcus granulosus thyroid hormone receptor alpha 0.0006 0.0158 0.0583
Onchocerca volvulus 0.0029 0.2099 0.2099
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0006 0.0158 0.0583
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0693 0.2558
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0429 0.1581
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Brugia malayi nuclear hormone receptor 0.0006 0.0158 0.0158
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0228 0.1806
Schistosoma mansoni ap endonuclease 0.0019 0.1264 0.2628
Schistosoma mansoni cpg binding protein 0.0031 0.2237 0.465
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.1264 1
Onchocerca volvulus Huntingtin homolog 0.0124 1 1
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0429 0.0429
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0228 0.1806
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0228 0.1806
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0012 0.0693 0.0693
Loa Loa (eye worm) hypothetical protein 0.0006 0.0158 0.0158
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0012 0.0693 0.1441
Brugia malayi steroid hormone receptor 0.0012 0.0693 0.0693
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0429 0.1581
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0228 0.1806

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 3.1623 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] 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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