Detailed information for compound 829720

Basic information

Technical information
  • TDR Targets ID: 829720
  • Name: 2-(3-tert-butyl-5,9-dimethyl-7-oxofuro[3,2-g] chromen-6-yl)-N-[(4-methoxyphenyl)methyl]acet amide
  • MW: 447.523 | Formula: C27H29NO5
  • H donors: 1 H acceptors: 2 LogP: 4.95 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)CNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C
  • InChi: 1S/C27H29NO5/c1-15-19-11-21-22(27(3,4)5)14-32-24(21)16(2)25(19)33-26(30)20(15)12-23(29)28-13-17-7-9-18(31-6)10-8-17/h7-11,14H,12-13H2,1-6H3,(H,28,29)
  • InChiKey: UZLIYLJTYCCVND-UHFFFAOYSA-N  

Network

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Synonyms

  • 2-(3-tert-butyl-5,9-dimethyl-7-oxo-furo[3,2-g]chromen-6-yl)-N-[(4-methoxyphenyl)methyl]acetamide
  • 2-(3-tert-butyl-5,9-dimethyl-7-oxo-6-furo[3,2-g]chromenyl)-N-[(4-methoxyphenyl)methyl]acetamide
  • 2-(3-tert-butyl-7-keto-5,9-dimethyl-furo[3,2-g]chromen-6-yl)-N-(4-methoxybenzyl)acetamide
  • 2-(3-tert-butyl-5,9-dimethyl-7-oxo-furo[3,2-g]chromen-6-yl)-N-[(4-methoxyphenyl)methyl]ethanamide

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
Loa Loa (eye worm) proteasome subunit beta type 2 0.0252 0.1946 0.1946
Trypanosoma cruzi proteasome beta 6 subunit, putative 0.0406 0.3964 0.3964
Echinococcus granulosus proteasome prosome macropain subunit beta 0.0406 0.3964 0.7224
Onchocerca volvulus 0.0162 0.0777 1
Giardia lamblia Proteasome subunit beta type 1 0.0406 0.3964 0.7224
Trypanosoma cruzi 20S proteasome subunit 0.0252 0.1946 0.1946
Leishmania major proteasome beta 6 subunit, putative,20S proteasome beta 6 subunit, putative 0.0406 0.3964 0.3964
Trypanosoma cruzi Emopamil binding protein, putative 0.0162 0.0777 0.0777
Wolbachia endosymbiont of Brugia malayi ATP-dependent protease peptidase subunit 0.0103 0 0.5
Plasmodium falciparum proteasome subunit beta type-2, putative 0.0252 0.1946 0.3546
Mycobacterium tuberculosis Proteasome beta subunit PrcB; assembles with alpha subunit PrcA. 0.0523 0.5487 1
Loa Loa (eye worm) proteasome A-type and B-type family protein 0.0523 0.5487 0.5487
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0523 0.5487 1
Schistosoma mansoni proteasome subunit beta 2 (T01 family) 0.0252 0.1946 0.3546
Plasmodium vivax proteasome subunit beta type-5, putative 0.0523 0.5487 1
Toxoplasma gondii proteasome subunit beta type 2, putative 0.0252 0.1946 0.3546
Plasmodium falciparum proteasome subunit beta type-1, putative 0.0406 0.3964 0.7224
Echinococcus granulosus proteasome prosome macropain subunit beta 0.0252 0.1946 0.3546
Echinococcus multilocularis proteasome (prosome, macropain) 0.0523 0.5487 1
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0406 0.3964 0.7224
Trypanosoma cruzi 3-Beta-hydroxysteroid-delta(8), delta(7)-isomerase, putative 0.0162 0.0777 0.0777
Plasmodium falciparum proteasome subunit beta type-5 0.0523 0.5487 1
Echinococcus granulosus proteasome prosome macropain 0.0523 0.5487 1
Giardia lamblia Proteasome subunit beta type 5 precursor 0.0523 0.5487 1
Trypanosoma cruzi Emopamil binding protein, putative 0.0162 0.0777 0.0777
Echinococcus multilocularis proteasome (prosome, macropain) subunit, beta 0.0406 0.3964 0.7224
Leishmania major proteasome beta 5 subunit, putative 0.0523 0.5487 0.5487
Trypanosoma brucei proteasome subunit beta type-2, putative 0.0252 0.1946 0.1946
Trypanosoma brucei Emopamil binding protein, putative 0.0162 0.0777 0.0777
Mycobacterium ulcerans proteasome PrcB 0.0523 0.5487 1
Trypanosoma brucei C-8 sterol isomerase, putative 0.0868 1 1
Schistosoma mansoni proteasome catalytic subunit 3 (T01 family) 0.0523 0.5487 1
Toxoplasma gondii proteasome subunit beta type, putative 0.0523 0.5487 1
Leishmania major 3-Beta-hydroxysteroid-delta(8), delta(7)-isomerase, putative 0.0162 0.0777 0.0777
Trypanosoma cruzi proteasome subunit beta type-2, putative 0.0252 0.1946 0.1946
Leishmania major proteasome beta 2 subunit, putative 0.0252 0.1946 0.1946
Trypanosoma cruzi 3-Beta-hydroxysteroid-delta(8), delta(7)-isomerase, putative 0.0162 0.0777 0.0777
Mycobacterium leprae proteasome (beta subunit) PrcB 0.0523 0.5487 1
Entamoeba histolytica probable proteasome subunit beta type 2, putative 0.0252 0.1946 0.3546
Trypanosoma brucei proteasome beta 6 subunit 0.0406 0.3964 0.3964
Entamoeba histolytica proteasome subunit beta type 5 precursor, putative 0.0523 0.5487 1
Plasmodium vivax proteasome subunit beta type-2, putative 0.0252 0.1946 0.3546
Giardia lamblia Proteasome subunit beta type 2 0.0252 0.1946 0.3546
Leishmania major hypothetical protein, conserved 0.0162 0.0777 0.0777
Plasmodium vivax proteasome subunit beta type-1, putative 0.0406 0.3964 0.7224
Schistosoma mansoni proteasome subunit beta 1 (T01 family) 0.0406 0.3964 0.7224
Loa Loa (eye worm) proteasome subunit beta type 1 0.0406 0.3964 0.3964
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0252 0.1946 0.3546
Entamoeba histolytica proteasome subunit beta type 1, putative 0.0406 0.3964 0.7224
Trypanosoma cruzi proteasome subunit beta type-5, putative 0.0523 0.5487 0.5487
Brugia malayi Proteasome A-type and B-type family protein 0.0523 0.5487 0.5487
Loa Loa (eye worm) hypothetical protein 0.0868 1 1
Schistosoma mansoni proteasome subunit beta 2 (T01 family) 0.0252 0.1946 0.3546
Loa Loa (eye worm) hypothetical protein 0.0444 0.4455 0.4455
Brugia malayi proteasome subunit beta type 1 0.0406 0.3964 0.3964
Leishmania major C-8 sterol isomerase-like protein 0.0868 1 1
Echinococcus multilocularis proteasome (prosome, macropain) subunit, beta 0.0252 0.1946 0.3546
Toxoplasma gondii proteasome subunit beta type 1, putative 0.0406 0.3964 0.7224
Trypanosoma brucei proteasome subunit beta type-5, putative 0.0523 0.5487 0.5487
Trypanosoma cruzi proteasome subunit beta type-5, putative 0.0523 0.5487 0.5487
Trypanosoma cruzi proteasome beta 6 subunit, putative 0.0406 0.3964 0.3964
Brugia malayi proteasome subunit beta type 2 0.0252 0.1946 0.1946
Trypanosoma cruzi C-8 sterol isomerase, putative 0.0868 1 1
Trichomonas vaginalis Family T1, proteasome beta subunit, threonine peptidase 0.0252 0.1946 0.3546

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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