Detailed information for compound 799141

Basic information

Technical information
  • TDR Targets ID: 799141
  • Name: N-butan-2-yl-4-[(4-chlorophenyl)methyl]-3-oxo -1,4-benzothiazine-6-carboxamide
  • MW: 388.911 | Formula: C20H21ClN2O2S
  • H donors: 1 H acceptors: 2 LogP: 4.32 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCC(NC(=O)c1ccc2c(c1)N(Cc1ccc(cc1)Cl)C(=O)CS2)C
  • InChi: 1S/C20H21ClN2O2S/c1-3-13(2)22-20(25)15-6-9-18-17(10-15)23(19(24)12-26-18)11-14-4-7-16(21)8-5-14/h4-10,13H,3,11-12H2,1-2H3,(H,22,25)
  • InChiKey: NPEQHOGNXDUQOZ-UHFFFAOYSA-N  

Network

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Synonyms

  • 4-[(4-chlorophenyl)methyl]-3-oxo-N-sec-butyl-1,4-benzothiazine-6-carboxamide
  • 4-(4-chlorobenzyl)-3-keto-N-sec-butyl-1,4-benzothiazine-6-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
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0095 0.4552 0.5131
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.4552 1
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.1527 0.0977
Loa Loa (eye worm) troponin 0.0064 0.2993 0.2538
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.4552 1
Brugia malayi Troponin I 0.0108 0.517 0.4856
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0004 0 0.5
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0095 0.4552 0.5131
Loa Loa (eye worm) hypothetical protein 0.0108 0.517 0.4856
Loa Loa (eye worm) troponin T 0.0064 0.2993 0.2538
Echinococcus multilocularis oncosphere protein tso22e oncosphere protein tso22d oncosphere protein tso22c oncosphere protein tso22b oncosphere protein tso22 0.0134 0.6456 0.761
Schistosoma mansoni troponin t invertebrate 0.0134 0.6456 1
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0095 0.4552 0.4198
Trypanosoma cruzi polo-like protein kinase, putative 0.0095 0.4552 1
Echinococcus granulosus troponin i 0.0108 0.517 0.5935
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0171 0.8293 1
Onchocerca volvulus Troponin I homolog 0.0108 0.517 0.6284
Echinococcus multilocularis troponin i 0.0108 0.517 0.5935
Schistosoma mansoni hypothetical protein 0.0034 0.1527 0.1569
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.2317 0.1818
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.4552 1
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.4552 1
Schistosoma mansoni troponin I 0.0108 0.517 0.7799
Loa Loa (eye worm) hypothetical protein 0.0205 1 1
Echinococcus granulosus oncosphere protein Tso22e 0.0134 0.6456 0.761
Schistosoma mansoni troponin I 0.0108 0.517 0.7799
Schistosoma mansoni kinase 0.0049 0.2225 0.2762
Schistosoma mansoni hypothetical protein 0.0108 0.517 0.7799
Schistosoma mansoni troponin I 0.0108 0.517 0.7799
Brugia malayi Troponin family protein 0.0108 0.517 0.4856
Brugia malayi Troponin T 0.0064 0.2993 0.2538
Brugia malayi serine/threonine-protein kinase plk-2 0.0095 0.4552 0.4198
Brugia malayi Troponin T 0.0064 0.2993 0.2538
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.4552 1
Schistosoma mansoni troponin I 0.0108 0.517 0.7799
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0171 0.8293 1
Loa Loa (eye worm) hypothetical protein 0.0064 0.2993 0.2538
Onchocerca volvulus Troponin T, skeletal muscle homolog 0.0134 0.6456 1
Brugia malayi Troponin T 0.0064 0.2993 0.2538
Loa Loa (eye worm) troponin I 0.0108 0.517 0.4856
Loa Loa (eye worm) hypothetical protein 0.0034 0.1527 0.0977
Loa Loa (eye worm) hypothetical protein 0.0108 0.517 0.4856
Trypanosoma cruzi polo-like protein kinase, putative 0.0095 0.4552 1
Trypanosoma brucei polo-like protein kinase 0.0095 0.4552 1
Schistosoma mansoni serine/threonine protein kinase 0.0095 0.4552 0.6743
Onchocerca volvulus Serine\/threonine kinase homolog 0.0095 0.4552 0.4501
Brugia malayi hypothetical protein 0.0064 0.2993 0.2538
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0095 0.4552 1
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.4552 1
Entamoeba histolytica serine/threonine protein kinase, putative 0.0095 0.4552 0.5
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.4552 1
Giardia lamblia Kinase, PLK 0.0095 0.4552 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.2317 0.1818

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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