Detailed information for compound 832714

Basic information

Technical information
  • TDR Targets ID: 832714
  • Name: butyl 4-[(6-ethyl-4-oxochromene-2-carbonyl)am ino]benzoate
  • MW: 393.432 | Formula: C23H23NO5
  • H donors: 1 H acceptors: 3 LogP: 4.49 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCOC(=O)c1ccc(cc1)NC(=O)c1cc(=O)c2c(o1)ccc(c2)CC
  • InChi: 1S/C23H23NO5/c1-3-5-12-28-23(27)16-7-9-17(10-8-16)24-22(26)21-14-19(25)18-13-15(4-2)6-11-20(18)29-21/h6-11,13-14H,3-5,12H2,1-2H3,(H,24,26)
  • InChiKey: FUPFSZCAFJGNNN-UHFFFAOYSA-N  

Network

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Synonyms

  • butyl 4-[(6-ethyl-4-oxo-chromene-2-carbonyl)amino]benzoate
  • 4-[[(6-ethyl-4-oxo-2-chromenyl)-oxomethyl]amino]benzoic acid butyl ester
  • 4-[(6-ethyl-4-keto-chromene-2-carbonyl)amino]benzoic acid butyl ester
  • butyl 4-[(6-ethyl-4-oxo-chromen-2-yl)carbonylamino]benzoate

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
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0086 0.0638 0.0638
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0082 0.0558 0.0558
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0082 0.0558 0.0558
Loa Loa (eye worm) hypothetical protein 0.0082 0.0558 0.0558
Schistosoma mansoni sodium/chloride dependent transporter 0.0486 1 1
Plasmodium vivax hypothetical protein, conserved 0.0082 0.0558 0.5
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0082 0.0558 0.0558
Schistosoma mansoni voltage-gated potassium channel 0.0086 0.0638 0.0638
Loa Loa (eye worm) serotonin transporter b 0.0486 1 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0082 0.0558 0.0558
Toxoplasma gondii hypothetical protein 0.0082 0.0558 0.5
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0082 0.0558 0.0558
Brugia malayi hypothetical protein 0.0082 0.0558 0.0558
Plasmodium vivax amine transporter, putative 0.0082 0.0558 0.5
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0082 0.0558 0.0558
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0297 0.5567 0.5567
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0082 0.0558 0.5
Loa Loa (eye worm) norepinephrine transporter 0.0486 1 1
Schistosoma mansoni sodium/chloride dependent transporter 0.0082 0.0558 0.0558
Echinococcus granulosus sodium and chloride dependent glycine 0.0082 0.0558 0.0558
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0297 0.5567 0.5567
Onchocerca volvulus 0.0486 1 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0082 0.0558 0.0558
Schistosoma mansoni voltage-gated potassium channel 0.0324 0.6204 0.6204
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0297 0.5567 0.5567
Loa Loa (eye worm) hypothetical protein 0.0486 1 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0277 0.511 1
Plasmodium falciparum transporter, putative 0.0082 0.0558 0.5
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0082 0.0558 0.0558
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0086 0.0638 0.0638
Treponema pallidum sodium- and chloride- dependent transporter 0.0486 1 0.5
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0082 0.0558 0.0558
Echinococcus granulosus voltage gated potassium channel 0.0086 0.0638 0.0638
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0082 0.0558 0.0558
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0082 0.0558 0.0558
Echinococcus granulosus serotonin transporter 0.0486 1 1
Schistosoma mansoni sodium-dependent amino acid transporter 0.0082 0.0558 0.0558
Plasmodium falciparum amino acid transporter, putative 0.0082 0.0558 0.5
Loa Loa (eye worm) hypothetical protein 0.0086 0.0638 0.0638
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0082 0.0558 0.0558
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0082 0.0558 0.0558
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.0082 0.0558 0.5
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0086 0.0638 0.0638
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0082 0.0558 0.0558
Schistosoma mansoni voltage-gated potassium channel 0.0324 0.6204 0.6204
Loa Loa (eye worm) hypothetical protein 0.0486 1 1
Schistosoma mansoni voltage-gated potassium channel 0.0086 0.0638 0.0638
Echinococcus multilocularis sodium and chloride dependent glycine 0.0082 0.0558 0.0558
Echinococcus granulosus sodium and chloride dependent glycine 0.0082 0.0558 0.0558
Loa Loa (eye worm) hypothetical protein 0.0082 0.0558 0.0558
Loa Loa (eye worm) hypothetical protein 0.0257 0.465 0.465
Loa Loa (eye worm) hypothetical protein 0.0082 0.0558 0.0558
Loa Loa (eye worm) hypothetical protein 0.0082 0.0558 0.0558
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0082 0.0558 0.5
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0082 0.0558 0.0558
Loa Loa (eye worm) solute carrier family 6 member 4 0.0486 1 1
Loa Loa (eye worm) hypothetical protein 0.0486 1 1
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0082 0.0558 0.0558
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0082 0.0558 0.0558
Loa Loa (eye worm) hypothetical protein 0.0082 0.0558 0.0558
Echinococcus multilocularis sodium and chloride dependent glycine 0.0082 0.0558 0.0558
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0082 0.0558 0.0558
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0082 0.0558 0.0558
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0277 0.511 1
Echinococcus multilocularis serotonin transporter 0.0486 1 1
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0082 0.0558 0.5
Schistosoma mansoni sodium/chloride dependent transporter 0.0082 0.0558 0.0558
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0082 0.0558 0.0558
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0486 1 1
Echinococcus multilocularis voltage gated potassium channel 0.0086 0.0638 0.0638
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0297 0.5567 0.5567
Loa Loa (eye worm) hypothetical protein 0.0082 0.0558 0.0558
Toxoplasma gondii hypothetical protein 0.0082 0.0558 0.5
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0082 0.0558 0.0558
Loa Loa (eye worm) hypothetical protein 0.0082 0.0558 0.0558

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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