Detailed information for compound 775413

Basic information

Technical information
  • TDR Targets ID: 775413
  • Name: N-(4-methoxyphenyl)sulfonyl-N-(6,7,8,9-tetrah ydrodibenzofuran-2-yl)butanamide
  • MW: 427.513 | Formula: C23H25NO5S
  • H donors: 0 H acceptors: 3 LogP: 4.84 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCC(=O)N(S(=O)(=O)c1ccc(cc1)OC)c1ccc2c(c1)c1CCCCc1o2
  • InChi: 1S/C23H25NO5S/c1-3-6-23(25)24(30(26,27)18-12-10-17(28-2)11-13-18)16-9-14-22-20(15-16)19-7-4-5-8-21(19)29-22/h9-15H,3-8H2,1-2H3
  • InChiKey: AWBCNZYRBYXGKI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(4-methoxyphenyl)sulfonyl-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)butyramide
  • ZINC02184832
  • AQ-390/41639240
  • Oprea1_826424
  • Oprea1_637854

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
Trypanosoma cruzi DNA repair and recombination helicase protein PIF7, putative 0.0328 1 1
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0023 0.051 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.051 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.2598 0.2598
Mycobacterium ulcerans hypothetical protein 0.0023 0.051 1
Plasmodium vivax acyl-CoA synthetase, putative 0.0017 0.0327 0.5
Trypanosoma cruzi DNA repair and recombination helicase protein PIF7, putative 0.0328 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.2598 0.2598
Loa Loa (eye worm) hypothetical protein 0.0023 0.051 0.1964
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.051 1
Trichomonas vaginalis conserved hypothetical protein 0.0328 1 0.5
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.009 0.2598 1
Echinococcus multilocularis ATP dependent DNA helicase PIF1 0.0328 1 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0327 0.1257
Brugia malayi Cytochrome P450 family protein 0.0044 0.1164 0.448
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.051 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.2598 0.2598
Entamoeba histolytica DNA repair and recombination protein, putative 0.0328 1 1
Brugia malayi AMP-binding enzyme family protein 0.0023 0.051 0.1964
Loa Loa (eye worm) hypothetical protein 0.0017 0.0327 0.1257
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0017 0.0327 0.6402
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0017 0.0327 0.6402
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0017 0.0327 0.5
Brugia malayi AMP-binding enzyme family protein 0.0023 0.051 0.1964
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0023 0.051 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.009 0.2598 1
Brugia malayi AMP-binding enzyme family protein 0.0023 0.051 0.1964
Giardia lamblia Rrm3p helicase 0.0328 1 0.5
Plasmodium falciparum acyl-CoA synthetase 0.0017 0.0327 0.5
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.051 0.051
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0023 0.051 1
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0023 0.051 1
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.051 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.2598 0.2598
Loa Loa (eye worm) hypothetical protein 0.0017 0.0327 0.1257
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.2598 0.2598
Leishmania major PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative 0.0328 1 1
Onchocerca volvulus 0.0023 0.051 0.5
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.051 0.051
Trypanosoma cruzi DNA repair and recombination helicase protein PIF6, putative 0.0328 1 1
Leishmania major PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative 0.0328 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.2598 0.2598
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.051 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0327 0.1257
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0297 0.5821
Loa Loa (eye worm) cytochrome P450 family protein 0.0044 0.1164 0.448
Entamoeba histolytica hypothetical protein, conserved 0.0328 1 1
Trypanosoma brucei DNA repair and recombination helicase protein PIF7 0.0328 1 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0297 0.5821
Loa Loa (eye worm) hypothetical protein 0.0017 0.0327 0.1257
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0297 0.5821
Schistosoma mansoni hypothetical protein 0.0328 1 1
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.051 1
Toxoplasma gondii cytochrome p450 superfamily protein 0.0007 0 0.5
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.051 0.051
Trypanosoma brucei DNA repair and recombination helicase protein PIF6 0.0328 1 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0297 0.5821
Loa Loa (eye worm) hypothetical protein 0.0023 0.051 0.1964
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.2598 0.2598
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.051 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.051 0.1964

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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