Detailed information for compound 1469313

Basic information

Technical information
  • TDR Targets ID: 1469313
  • Name: N-(1,3-benzodioxol-4-yl)-2-(dipropylamino)ace tamide
  • MW: 278.347 | Formula: C15H22N2O3
  • H donors: 1 H acceptors: 1 LogP: 2.77 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCN(CC(=O)Nc1cccc2c1OCO2)CCC
  • InChi: 1S/C15H22N2O3/c1-3-8-17(9-4-2)10-14(18)16-12-6-5-7-13-15(12)20-11-19-13/h5-7H,3-4,8-11H2,1-2H3,(H,16,18)
  • InChiKey: YJXVGYRMTXFTQF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(1,3-benzodioxol-4-yl)-2-(dipropylamino)ethanamide
  • STOCK1S-55299

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
Leishmania major cytochrome p450-like protein 0.0058 0.0064 0.0043
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0039 0.0021 0.5
Loa Loa (eye worm) hypothetical protein 0.0055 0.0056 0.0056
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0058 0.0064 1
Echinococcus granulosus roundabout 2 0.0067 0.0082 0.0061
Brugia malayi serine/threonine protein kinase 6 0.0081 0.0115 0.0093
Trichomonas vaginalis CAMK family protein kinase 0.456 1 1
Onchocerca volvulus Serine\/threonine kinase homolog 0.456 1 1
Schistosoma mansoni nephrin 0.006 0.0067 0.0046
Trichomonas vaginalis CAMK family protein kinase 0.456 1 1
Loa Loa (eye worm) cytochrome P450 0.0039 0.0021 0.0021
Loa Loa (eye worm) hypothetical protein 0.0061 0.0071 0.0071
Schistosoma mansoni protein kinase 0.0081 0.0115 0.0093
Echinococcus multilocularis Serine:threonine protein kinase PLK4 0.1548 0.3352 0.3338
Loa Loa (eye worm) hypothetical protein 0.0055 0.0056 0.0056
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0039 0.0021 0.5
Schistosoma mansoni serine/threonine protein kinase 0.0081 0.0115 0.0093
Loa Loa (eye worm) hypothetical protein 0.0067 0.0082 0.0082
Brugia malayi hypothetical protein 0.0055 0.0056 0.0035
Trypanosoma cruzi polo-like protein kinase, putative 0.456 1 1
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0039 0.0021 0.5
Leishmania major protein kinase, putative 0.0081 0.0115 0.0093
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0039 0.0021 0.5
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.456 1 1
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0055 0.0056 0.0035
Trichomonas vaginalis CAMK family protein kinase 0.1935 0.4206 0.4139
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0039 0.0021 0.5
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0039 0.0021 0.5
Plasmodium vivax serine/threonine protein kinase 6, putative 0.0081 0.0115 0.5
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0039 0.0021 0.5
Brugia malayi serine/threonine-protein kinase 6 0.0081 0.0115 0.0093
Echinococcus granulosus neuroglian 0.006 0.0067 0.0046
Trichomonas vaginalis CAMK family protein kinase 0.456 1 1
Trichomonas vaginalis CAMK family protein kinase 0.1935 0.4206 0.4139
Brugia malayi Immunoglobulin I-set domain containing protein 0.0055 0.0056 0.0035
Echinococcus granulosus defective proboscis extension response 0.0055 0.0056 0.0035
Trypanosoma cruzi aurora B kinase, putative 0.0081 0.0115 0.0093
Schistosoma mansoni vesicular amine transporter 0.0055 0.0056 0.0035
Trichomonas vaginalis CAMK family protein kinase 0.456 1 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0058 0.0064 0.0064
Trypanosoma cruzi polo-like protein kinase, putative 0.456 1 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0371 0.0753 0.0733
Onchocerca volvulus Tyrosine kinase homolog 0.0314 0.0629 0.0024
Echinococcus multilocularis Immunoglobulin 0.0055 0.0056 0.0035
Loa Loa (eye worm) AUR protein kinase 0.0081 0.0115 0.0115
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0039 0.0021 0.5
Trypanosoma cruzi cytochrome P450, putative 0.0058 0.0064 0.0043
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0061 0.0071 0.0049
Brugia malayi Cytochrome P450 family protein 0.0058 0.0064 0.0043
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0055 0.0056 0.0035
Loa Loa (eye worm) hypothetical protein 0.0055 0.0056 0.0056
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0039 0.0021 0.5
Trichomonas vaginalis CAMK family protein kinase 0.456 1 1
Echinococcus multilocularis neuroglian 0.006 0.0067 0.0046
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0039 0.0021 0.5
Echinococcus multilocularis roundabout 2 0.0067 0.0082 0.0061
Echinococcus multilocularis aurora kinase A 0.0081 0.0115 0.0093
Echinococcus multilocularis Immunoglobulin 0.0055 0.0056 0.0035
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0039 0.0021 0.5
Loa Loa (eye worm) AUR protein kinase 0.0081 0.0115 0.0115
Brugia malayi Fibronectin type III domain containing protein 0.0055 0.0056 0.0035
Loa Loa (eye worm) AUR protein kinase 0.0081 0.0115 0.0115
Echinococcus granulosus Serine:threonine protein kinase PLK4 0.1548 0.3352 0.3338
Giardia lamblia Kinase, PLK 0.456 1 1
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0039 0.0021 0.5
Trypanosoma cruzi cytochrome P450, putative 0.0058 0.0064 0.0043
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0039 0.0021 0.5
Toxoplasma gondii aurora kinase 0.0081 0.0115 1
Echinococcus granulosus serine:threonine protein kinase 12 B 0.0081 0.0115 0.0093
Trichomonas vaginalis CAMK family protein kinase 0.456 1 1
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0039 0.0021 0.5
Plasmodium falciparum serine/threonine protein kinase, putative 0.0081 0.0115 0.5
Trypanosoma brucei cytochrome P450, putative 0.0058 0.0064 0.0043
Brugia malayi Cytochrome P450 family protein 0.0058 0.0064 0.0043
Brugia malayi serine/threonine kinase 12 0.0081 0.0115 0.0093
Trypanosoma brucei polo-like protein kinase 0.456 1 1
Echinococcus multilocularis serine:threonine protein kinase 12 B 0.0081 0.0115 0.0093
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0039 0.0021 0.5
Brugia malayi Cytochrome P450 family protein 0.0123 0.0207 0.0186
Loa Loa (eye worm) hypothetical protein 0.0055 0.0056 0.0056
Schistosoma mansoni serine/threonine protein kinase 0.456 1 1
Echinococcus granulosus serine:threonine protein kinase PLK1 0.456 1 1
Entamoeba histolytica serine/threonine protein kinase, putative 0.456 1 1
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.456 1 1
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0039 0.0021 0.5
Schistosoma mansoni cell adhesion molecule 0.0061 0.0071 0.0049
Loa Loa (eye worm) hypothetical protein 0.0055 0.0056 0.0056
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0039 0.0021 0.5
Trichomonas vaginalis CAMK family protein kinase 0.456 1 1
Mycobacterium leprae Conserved hypothetical protein 0.0039 0.0021 0.5
Trypanosoma brucei aurora B kinase 0.0081 0.0115 0.0093
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0039 0.0021 0.5
Echinococcus granulosus twitchin 0.0077 0.0106 0.0085
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0039 0.0021 0.5
Mycobacterium leprae putative cytochrome p450 0.0039 0.0021 0.5
Echinococcus granulosus Immunoglobulin 0.0055 0.0056 0.0035
Loa Loa (eye worm) CYP4Cod1 0.0058 0.0064 0.0064
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0055 0.0056 0.0035
Loa Loa (eye worm) hypothetical protein 0.0055 0.0056 0.0056
Schistosoma mansoni kinase 0.4173 0.9146 0.9145
Loa Loa (eye worm) cytochrome P450 family protein 0.0123 0.0207 0.0207
Loa Loa (eye worm) cytochrome P450 family protein 0.0058 0.0064 0.0064
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.456 1 1
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0371 0.0753 0.0753
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0039 0.0021 0.5
Loa Loa (eye worm) hypothetical protein 0.0067 0.0082 0.0082
Echinococcus granulosus aurora kinase A 0.0081 0.0115 0.0093

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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