Detailed information for compound 871496

Basic information

Technical information
  • TDR Targets ID: 871496
  • Name: methyl 4-[(2-carbamoyl-1-benzofuran-3-yl)carb amoyl]benzoate
  • MW: 338.314 | Formula: C18H14N2O5
  • H donors: 2 H acceptors: 3 LogP: 2.77 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)c1ccc(cc1)C(=O)Nc1c(oc2c1cccc2)C(=O)N
  • InChi: 1S/C18H14N2O5/c1-24-18(23)11-8-6-10(7-9-11)17(22)20-14-12-4-2-3-5-13(12)25-15(14)16(19)21/h2-9H,1H3,(H2,19,21)(H,20,22)
  • InChiKey: CEVRRKKEECWCBU-UHFFFAOYSA-N  

Network

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Synonyms

  • methyl 4-[(2-carbamoylbenzofuran-3-yl)carbamoyl]benzoate
  • 4-[[(2-carbamoyl-3-benzofuranyl)amino]-oxomethyl]benzoic acid methyl ester
  • 4-[(2-carbamoylbenzofuran-3-yl)carbamoyl]benzoic acid methyl ester
  • methyl 4-[(2-aminocarbonyl-1-benzofuran-3-yl)carbamoyl]benzoate
  • ZINC00240282
  • EU-0006336
  • Oprea1_757419

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
Echinococcus multilocularis snurportin 1 0.0303 0.072 0.072
Schistosoma mansoni hypothetical protein 0.0034 0.0032 0.0032
Trichomonas vaginalis importin beta-1, putative 0.0023 0.0005 1
Echinococcus granulosus snurportin 1 0.0303 0.072 0.072
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0028 0.0018 0.0018
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0028 0.0018 0.0018
Loa Loa (eye worm) hypothetical protein 0.0028 0.0018 0.0018
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0072 0.0072
Treponema pallidum sodium- and chloride- dependent transporter 0.0165 0.0368 0.5
Loa Loa (eye worm) hypothetical protein 0.0165 0.0368 0.0368
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.0028 0.0018 0.5
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0028 0.0018 0.0018
Schistosoma mansoni sodium/chloride dependent transporter 0.0028 0.0018 0.0018
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0019 0.0046
Plasmodium falciparum transporter, putative 0.0028 0.0018 0.9541
Onchocerca volvulus 0.0165 0.0368 0.0351
Loa Loa (eye worm) vesicular acetylcholine transporter unc-17 0.3935 1 1
Echinococcus multilocularis vesicular acetylcholine transporter 0.3935 1 1
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0028 0.0018 0.0018
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0028 0.0018 0.0018
Loa Loa (eye worm) hypothetical protein 0.0028 0.0018 0.0018
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0028 0.0018 0.0018
Echinococcus granulosus geminin 0.0167 0.0373 0.0373
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0303 0.072 0.072
Loa Loa (eye worm) serotonin transporter b 0.0165 0.0368 0.0368
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0028 0.0018 0.0018
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0028 0.0018 0.0018
Onchocerca volvulus Vesicular acetylcholine transporter homolog 0.3935 1 1
Leishmania major importin beta-1 subunit, putative 0.0023 0.0005 0.0013
Brugia malayi Importin beta-1 subunit 0.0028 0.0019 0.0019
Loa Loa (eye worm) hypothetical protein 0.0049 0.0072 0.0072
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0028 0.0018 0.9541
Loa Loa (eye worm) solute carrier family 6 member 4 0.0165 0.0368 0.0368
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0019 0.0046
Trypanosoma cruzi C-8 sterol isomerase, putative 0.1664 0.4198 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0028 0.0018 0.0018
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0028 0.0018 0.0018
Schistosoma mansoni hypothetical protein 0.0303 0.072 0.072
Brugia malayi RNA, U transporter 1 0.0081 0.0153 0.0153
Echinococcus granulosus sodium and chloride dependent glycine 0.0028 0.0018 0.0018
Schistosoma mansoni sodium-dependent amino acid transporter 0.0028 0.0018 0.0018
Echinococcus granulosus vesicular acetylcholine transporter 0.3935 1 1
Schistosoma mansoni sodium/chloride dependent transporter 0.0028 0.0018 0.0018
Schistosoma mansoni importin beta-1 0.0028 0.0019 0.0019
Echinococcus granulosus sodium and chloride dependent glycine 0.0028 0.0018 0.0018
Schistosoma mansoni vesicular acetylcholine transporter 0.3935 1 1
Schistosoma mansoni sodium/chloride dependent transporter 0.0165 0.0368 0.0368
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0005 1
Loa Loa (eye worm) norepinephrine transporter 0.0165 0.0368 0.0368
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0028 0.0018 0.0018
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0028 0.0018 0.0018
Loa Loa (eye worm) hypothetical protein 0.0028 0.0018 0.0018
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0072 0.0072
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0028 0.0018 0.0018
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0028 0.0018 0.0018
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0021 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0028 0.0019 0.0019
Loa Loa (eye worm) hypothetical protein 0.0028 0.0018 0.0018
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0028 0.0018 0.0018
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0028 0.0018 0.0018
Echinococcus granulosus importin subunit beta 1 0.0028 0.0019 0.0019
Plasmodium falciparum importin beta, putative 0.0028 0.0019 1
Loa Loa (eye worm) hypothetical protein 0.0851 0.212 0.212
Toxoplasma gondii hypothetical protein 0.0028 0.0018 0.9541
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0028 0.0018 0.0018
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0072 0.0072
Loa Loa (eye worm) hypothetical protein 0.0028 0.0018 0.0018
Loa Loa (eye worm) hypothetical protein 0.0028 0.0018 0.0018
Brugia malayi ERG2 and Sigma1 receptor like protein 0.1664 0.4198 0.4198
Trypanosoma cruzi importin beta-1 subunit, putative 0.0023 0.0005 0.0013
Toxoplasma gondii HEAT repeat-containing protein 0.0028 0.0019 1
Loa Loa (eye worm) hypothetical protein 0.0165 0.0368 0.0368
Leishmania major C-8 sterol isomerase-like protein 0.1664 0.4198 1
Echinococcus multilocularis importin subunit beta 1 0.0028 0.0019 0.0019
Trypanosoma brucei C-8 sterol isomerase, putative 0.1664 0.4198 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0028 0.0018 0.0018
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0165 0.0368 0.0368
Loa Loa (eye worm) hypothetical protein 0.0165 0.0368 0.0368
Plasmodium vivax importin-beta 2, putative 0.0028 0.0019 1
Brugia malayi hypothetical protein 0.0028 0.0018 0.0018
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0028 0.0018 0.9541
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0165 0.0368 0.0368
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0005 1
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0028 0.0018 0.0018
Echinococcus multilocularis sodium and chloride dependent glycine 0.0028 0.0018 0.0018
Echinococcus multilocularis sodium and chloride dependent glycine 0.0028 0.0018 0.0018
Schistosoma mansoni hypothetical protein 0.0167 0.0373 0.0373
Schistosoma mansoni hypothetical protein 0.0167 0.0373 0.0373
Echinococcus multilocularis serotonin transporter 0.0165 0.0368 0.0368
Loa Loa (eye worm) hypothetical protein 0.1664 0.4198 0.4198
Entamoeba histolytica hypothetical protein 0.0023 0.0005 1
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0028 0.0018 0.0018
Loa Loa (eye worm) hypothetical protein 0.0028 0.0018 0.0018
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0028 0.0018 0.9541
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0028 0.0018 0.0018
Plasmodium falciparum amino acid transporter, putative 0.0028 0.0018 0.9541
Toxoplasma gondii hypothetical protein 0.0028 0.0018 0.9541
Plasmodium vivax hypothetical protein, conserved 0.0028 0.0018 0.9541
Echinococcus multilocularis geminin 0.0167 0.0373 0.0373
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0032 0.0032
Echinococcus granulosus serotonin transporter 0.0165 0.0368 0.0368
Plasmodium vivax amine transporter, putative 0.0028 0.0018 0.9541
Loa Loa (eye worm) hypothetical protein 0.0034 0.0032 0.0032

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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