Detailed information for compound 864202

Basic information

Technical information
  • TDR Targets ID: 864202
  • Name: 1-[2-[2-[(3-chlorophenyl)methylidene]-3-oxo-1 ,4-benzothiazin-4-yl]acetyl]piperidine-4-carb oxamide
  • MW: 455.957 | Formula: C23H22ClN3O3S
  • H donors: 1 H acceptors: 3 LogP: 3.25 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: NC(=O)C1CCN(CC1)C(=O)Cn1c(=O)c(=Cc2cccc(c2)Cl)sc2c1cccc2
  • InChi: 1S/C23H22ClN3O3S/c24-17-5-3-4-15(12-17)13-20-23(30)27(18-6-1-2-7-19(18)31-20)14-21(28)26-10-8-16(9-11-26)22(25)29/h1-7,12-13,16H,8-11,14H2,(H2,25,29)/b20-13-
  • InChiKey: SKHBFFZNKLVUBT-MOSHPQCFSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-[2-[2-[(3-chlorophenyl)methylene]-3-oxo-1,4-benzothiazin-4-yl]acetyl]piperidine-4-carboxamide
  • 1-[2-[2-[(3-chlorophenyl)methylene]-3-oxo-1,4-benzothiazin-4-yl]-1-oxoethyl]-4-piperidinecarboxamide
  • 1-[2-[2-(3-chlorobenzylidene)-3-keto-1,4-benzothiazin-4-yl]acetyl]isonipecotamide
  • 1-[2-[2-[(3-chlorophenyl)methylidene]-3-oxo-1,4-benzothiazin-4-yl]ethanoyl]piperidine-4-carboxamide

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
Toxoplasma gondii hypothetical protein 0.0218 0.0254 0.5
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0218 0.0254 1
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0302 0.0586 1
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0302 0.0586 0.5
Mycobacterium leprae conserved hypothetical protein 0.0218 0.0254 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Loa Loa (eye worm) hypothetical protein 0.1578 0.563 0.5554
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0302 0.0586 0.5
Mycobacterium ulcerans putative regulatory protein 0.0218 0.0254 1
Toxoplasma gondii hypothetical protein 0.0218 0.0254 0.5
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0218 0.0254 1
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0302 0.0586 0.5
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0302 0.0586 1
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0302 0.0586 0.5
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Loa Loa (eye worm) hypothetical protein 0.2599 0.9667 1
Toxoplasma gondii GAF domain-containing protein 0.0218 0.0254 0.5
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0302 0.0586 0.5
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.2683 1 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0302 0.0586 1
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0218 0.0254 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Mycobacterium ulcerans putative regulatory protein 0.0218 0.0254 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0302 0.0586 1
Loa Loa (eye worm) hypothetical protein 0.1732 0.6238 0.6224
Toxoplasma gondii hypothetical protein 0.0218 0.0254 0.5
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Trichomonas vaginalis conserved hypothetical protein 0.0302 0.0586 1
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Plasmodium falciparum GAF domain-related protein, putative 0.0218 0.0254 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Schistosoma mansoni NAALADASE L peptidase (M28 family) 0.1108 0.3771 1
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0302 0.0586 1
Loa Loa (eye worm) hypothetical protein 0.2381 0.8806 0.9051
Echinococcus multilocularis n acetylated alpha linked acidic dipeptidase 2 0.169 0.6075 0.5831
Plasmodium vivax hypothetical protein, conserved 0.0218 0.0254 0.5
Loa Loa (eye worm) hypothetical protein 0.1149 0.3934 0.3687
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.2683 1 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.

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