Detailed information for compound 829576

Basic information

Technical information
  • TDR Targets ID: 829576
  • Name: 1-methyl-N-(3-methylbutyl)-[1]benzoxolo[2,3-d ]pyrrole-2-carboxamide
  • MW: 284.353 | Formula: C17H20N2O2
  • H donors: 1 H acceptors: 1 LogP: 3.79 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(CCNC(=O)c1cc2c(n1C)c1c(o2)cccc1)C
  • InChi: 1S/C17H20N2O2/c1-11(2)8-9-18-17(20)13-10-15-16(19(13)3)12-6-4-5-7-14(12)21-15/h4-7,10-11H,8-9H2,1-3H3,(H,18,20)
  • InChiKey: IYVSMEUZIVDZHY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-isopentyl-1-methyl-benzofurano[2,3-d]pyrrole-2-carboxamide
  • N-isopentyl-1-methyl-2-benzofurano[2,3-d]pyrrolecarboxamide
  • N-isoamyl-1-methyl-benzofurano[2,3-d]pyrrole-2-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
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.002 0.2517 0.5
Schistosoma mansoni hypothetical protein 0.0034 0.607 1
Schistosoma mansoni hypothetical protein 0.0016 0.1509 0.2486
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.607 0.5371
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.001 0.0096 0.0381
Entamoeba histolytica recQ family DNA helicase 0.001 0.0096 0.0381
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 1 1
Loa Loa (eye worm) ATP-dependent DNA helicase 0.002 0.2517 0.2445
Entamoeba histolytica recQ family helicase, putative 0.002 0.2517 1
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.002 0.2517 1
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.002 0.2517 1
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.001 0.0096 1
Echinococcus granulosus bloom syndrome protein 0.002 0.2517 1
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.002 0.2517 1
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.002 0.2517 0.5
Schistosoma mansoni DNA helicase recq1 0.002 0.2517 0.4147
Brugia malayi Bloom's syndrome protein homolog 0.002 0.2517 0.1187
Loa Loa (eye worm) hypothetical protein 0.005 1 1
Schistosoma mansoni hypothetical protein 0.0016 0.1509 0.2486
Loa Loa (eye worm) hypothetical protein 0.002 0.2517 0.2445
Treponema pallidum ATP-dependent DNA helicase 0.001 0.0096 0.5
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.002 0.2517 1
Schistosoma mansoni hypothetical protein 0.0016 0.1509 0.2486
Loa Loa (eye worm) hypothetical protein 0.001 0.0096 0.0000000020559
Loa Loa (eye worm) RecQ helicase 0.002 0.2517 0.2445
Schistosoma mansoni DNA helicase recq5 0.002 0.2517 0.4147
Echinococcus multilocularis bloom syndrome protein 0.002 0.2517 1
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.002 0.2517 0.5
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.1509 0.1427
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.002 0.2517 0.1187
Trichomonas vaginalis DNA helicase recq, putative 0.002 0.2517 0.5
Loa Loa (eye worm) hypothetical protein 0.0016 0.1509 0.1427
Echinococcus granulosus ATP dependent DNA helicase Q5 0.002 0.2517 1
Schistosoma mansoni blooms syndrome DNA helicase 0.001 0.0096 0.0158
Trichomonas vaginalis DNA helicase recq, putative 0.002 0.2517 0.5
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.002 0.2517 0.5
Schistosoma mansoni hypothetical protein 0.0016 0.1509 0.2486
Echinococcus granulosus ATP dependent DNA helicase Q1 0.002 0.2517 1
Giardia lamblia Sgs1 DNA helicase, putative 0.002 0.2517 0.5
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.002 0.2517 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.607 0.6032
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.002 0.2517 0.1187
Trichomonas vaginalis DNA helicase recq1, putative 0.002 0.2517 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 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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