Detailed information for compound 611615

Basic information

Technical information
  • TDR Targets ID: 611615
  • Name: ethyl 3-[(2-methylbenzoyl)amino]-1-benzofuran -2-carboxylate
  • MW: 323.343 | Formula: C19H17NO4
  • H donors: 1 H acceptors: 2 LogP: 4.63 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)c1oc2c(c1NC(=O)c1ccccc1C)cccc2
  • InChi: 1S/C19H17NO4/c1-3-23-19(22)17-16(14-10-6-7-11-15(14)24-17)20-18(21)13-9-5-4-8-12(13)2/h4-11H,3H2,1-2H3,(H,20,21)
  • InChiKey: WUBBZESAXVQTTR-UHFFFAOYSA-N  

Network

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Synonyms

  • ethyl 3-[(2-methylbenzoyl)amino]benzofuran-2-carboxylate
  • 3-[[(2-methylphenyl)-oxomethyl]amino]-2-benzofurancarboxylic acid ethyl ester
  • 3-[(2-methylbenzoyl)amino]benzofuran-2-carboxylic acid ethyl ester
  • ethyl 3-[(2-methylphenyl)carbonylamino]-1-benzofuran-2-carboxylate
  • ZINC00253014

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 latrophilin 2 splice variant baaae 0.0038 0.075 0.1322
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0268 0.0981
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0013 0.0105 0.0069
Schistosoma mansoni hypothetical protein 0.0124 0.2969 0.2943
Loa Loa (eye worm) hypothetical protein 0.001 0.0037 0.006
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0019 0.0268 0.0981
Brugia malayi nuclear receptor NHR-88 0.001 0.0037 0.0065
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MF, Family M17 0.0044 0.0923 0.1251
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0037 0.0034
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0037 0.0034
Echinococcus granulosus cpg binding protein 0.0029 0.0539 0.0537
Loa Loa (eye worm) hypothetical protein 0.0055 0.1199 0.2108
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0037 0.0065
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0037 0.0034
Schistosoma mansoni hypothetical protein 0.0017 0.023 0.0193
Schistosoma mansoni ap endonuclease 0.0019 0.0267 0.0231
Onchocerca volvulus 0.0013 0.0105 0.0723
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0037 0.0065
Echinococcus multilocularis leucyl aminopeptidase 0.0044 0.0923 0.092
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0043 0.0892 0.9032
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0037 0.006
Schistosoma mansoni chromobox protein 0.0077 0.1763 0.1732
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0019 0.0268 0.0981
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0498 0.0873
Echinococcus granulosus Chromo domain 0.0013 0.0105 0.0102
Schistosoma mansoni hypothetical protein 0.0017 0.023 0.0193
Loa Loa (eye worm) hypothetical protein 0.0013 0.0105 0.018
Loa Loa (eye worm) hypothetical protein 0.0228 0.5677 1
Echinococcus granulosus GPCR family 2 0.0017 0.023 0.0227
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0017 0.023 0.0227
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0044 0.0923 0.1626
Brugia malayi cytosol aminopeptidase 0.0044 0.0923 0.1626
Echinococcus granulosus leucyl aminopeptidase 0.0044 0.0923 0.092
Brugia malayi ecdysteroid receptor 0.001 0.0037 0.0065
Trypanosoma brucei metallo-peptidase, Clan MF, Family M17 0.0044 0.0923 0.1251
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0267 0.0264
Loa Loa (eye worm) hypothetical protein 0.0013 0.0105 0.018
Toxoplasma gondii histone lysine methyltransferase SET1 0.0053 0.114 0.1915
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0037 0.006
Onchocerca volvulus 0.0013 0.0105 0.0723
Leishmania major cytosolic leucyl aminopeptidase,metallo-peptidase, Clan MF, Family M17 0.0222 0.5511 1
Echinococcus multilocularis geminin 0.017 0.4162 0.416
Schistosoma mansoni survival motor neuron protein 0.0047 0.0983 0.095
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MF, Family M17 0.0044 0.0923 0.1251
Echinococcus multilocularis leucyl aminopeptidase 0.0044 0.0923 0.092
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0037 0.0065
Loa Loa (eye worm) hypothetical protein 0.001 0.0037 0.006
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0055 0.1199 0.2108
Echinococcus granulosus geminin 0.017 0.4162 0.416
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0192 0.0526
Schistosoma mansoni hypothetical protein 0.017 0.4162 0.414
Echinococcus multilocularis chromobox protein 1 0.0077 0.1763 0.176
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0037 0.0065
Trypanosoma brucei metallo-peptidase, Clan MF, Family M17 0.0044 0.0923 0.1251
Schistosoma mansoni hypothetical protein 0.0013 0.0105 0.0069
Schistosoma mansoni hypothetical protein 0.0396 1 1
Loa Loa (eye worm) aminopeptidase in chromosome III 0.0044 0.0923 0.1621
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0983 0.1732
Loa Loa (eye worm) hypothetical protein 0.0043 0.0892 0.1567
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0017 0.023 0.0227
Entamoeba histolytica hypothetical protein 0.0035 0.068 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0105 0.018
Trypanosoma brucei metallo-peptidase, Clan MF, Family M17 0.0222 0.5511 1
Plasmodium vivax M17 leucyl aminopeptidase, putative 0.0222 0.5511 1
Brugia malayi Protein cec-1. 0.0013 0.0105 0.0185
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0124 0.2969 0.2967
Chlamydia trachomatis cytosol aminopeptidase 0.0222 0.5511 0.5
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0017 0.023 0.0227
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0037 0.0034
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0037 0.0065
Brugia malayi steroid hormone receptor 0.001 0.0037 0.0065
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0037 0.006
Onchocerca volvulus 0.0034 0.0652 0.6496
Schistosoma mansoni thyroid hormone receptor 0.0133 0.3225 0.32
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0037 0.0034
Loa Loa (eye worm) hypothetical protein 0.001 0.0037 0.006
Trichomonas vaginalis chromobox protein, putative 0.0046 0.0976 0.5254
Echinococcus multilocularis Chromobox protein 3 0.0013 0.0105 0.0102
Echinococcus multilocularis chromodomain helicase DNA binding protein 1 0.0013 0.0105 0.0102
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0037 0.0065
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0037 0.006
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0013 0.0105 0.0069
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0267 0.0264
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0267 0.0299
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0037 0.0065
Loa Loa (eye worm) hypothetical protein 0.001 0.0037 0.006
Echinococcus multilocularis Chromo domain 0.0013 0.0105 0.0102
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.0267 0.5
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0037 0.0034
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0037 0.0065
Trypanosoma brucei aminopeptidase, putative 0.0044 0.0923 0.1251
Onchocerca volvulus 0.0013 0.0121 0.0889
Echinococcus multilocularis survival motor neuron protein 1 0.0228 0.5677 0.5676
Mycobacterium ulcerans leucyl aminopeptidase 0.0222 0.5511 1
Echinococcus multilocularis dnaJ subfamily B 0.0396 1 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0037 0.006
Brugia malayi Associated with TFs and helicases family protein 0.0013 0.0105 0.0185
Trypanosoma cruzi metallo-peptidase, Clan MF, Family M17, putative 0.0222 0.5511 1
Echinococcus multilocularis leucine aminopeptidase protein 0.0222 0.5511 0.551
Schistosoma mansoni cpg binding protein 0.0028 0.0498 0.0463
Loa Loa (eye worm) hypothetical protein 0.0017 0.023 0.04
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0268 0.0981
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0037 0.0065
Onchocerca volvulus 0.0028 0.0498 0.4876
Schistosoma mansoni PwLAP aminopeptidase (M17 family) 0.0044 0.0923 0.0889
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0037 0.0034
Entamoeba histolytica hypothetical protein 0.0035 0.068 1
Echinococcus granulosus survival motor neuron protein 1 0.0228 0.5677 0.5676
Trichomonas vaginalis chromobox protein, putative 0.0077 0.1763 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0055 0.1199 0.2112
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0055 0.1199 0.2112
Brugia malayi hypothetical protein 0.0228 0.5677 1
Entamoeba histolytica hypothetical protein 0.0035 0.068 1
Schistosoma mansoni hypothetical protein 0.017 0.4162 0.414
Trichomonas vaginalis chromobox protein, putative 0.0077 0.1763 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0105 0.018
Schistosoma mansoni chromobox protein 0.0077 0.1763 0.1732
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.068 0.0677
Brugia malayi Aminopeptidase ZK353.6 in chromosome III 0.0044 0.0923 0.1626
Brugia malayi M-phase phosphoprotein, mpp8 0.0013 0.0105 0.0185
Loa Loa (eye worm) helicase 0.0013 0.0105 0.018
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0037 0.0034
Brugia malayi nuclear hormone receptor 0.001 0.0037 0.0065
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0267 0.0976
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0014 0.0146 0.0143
Echinococcus granulosus leucyl aminopeptidase 0.0044 0.0923 0.092
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0037 0.0065
Brugia malayi Valyl-tRNA synthetase 0.0013 0.0105 0.0185
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0037 0.0034
Brugia malayi CHD4 protein 0.0014 0.0146 0.0257
Brugia malayi Aminopeptidase W07G4.4 in chromosome V 0.0044 0.0923 0.1626
Schistosoma mansoni cpg binding protein 0.0029 0.0539 0.0504
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0267 0.047
Toxoplasma gondii leucyl aminopeptidase LAP 0.0222 0.5511 1
Trichomonas vaginalis conserved hypothetical protein 0.003 0.0567 0.2789
Schistosoma mansoni thyroid hormone receptor 0.0133 0.3225 0.32
Loa Loa (eye worm) hypothetical protein 0.001 0.0037 0.006
Echinococcus granulosus chromobox protein 1 0.0077 0.1763 0.176
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0268 0.0981
Echinococcus granulosus ankyrin repeat domain containing protein 17 0.0044 0.0923 0.092
Brugia malayi hypothetical protein 0.0035 0.068 0.1197
Mycobacterium leprae Probable cytosol aminopeptidase PepB 0.0222 0.5511 0.5
Loa Loa (eye worm) hypothetical protein 0.0034 0.0652 0.1144
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0013 0.0105 0.0069
Loa Loa (eye worm) hypothetical protein 0.0038 0.075 0.1317
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0037 0.0065
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.068 0.0677
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0267 0.0299
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0059 0.1303 0.1271
Trichomonas vaginalis conserved hypothetical protein 0.003 0.0567 0.2789
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0013 0.0121 0.0084
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0017 0.023 0.0227
Wolbachia endosymbiont of Brugia malayi leucyl aminopeptidase 0.0222 0.5511 1
Brugia malayi Type III restriction enzyme, res subunit family protein 0.0013 0.0105 0.0185
Loa Loa (eye worm) hypothetical protein 0.001 0.0037 0.006
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0037 0.0065
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0267 0.0976
Loa Loa (eye worm) hypothetical protein 0.0013 0.0105 0.018
Echinococcus granulosus leucine aminopeptidase protein 0.0222 0.5511 0.551
Brugia malayi Latrophilin receptor protein 2 0.0017 0.023 0.0404
Schistosoma mansoni ap endonuclease 0.0019 0.0267 0.0231
Echinococcus granulosus FTZ F1 alpha 0.001 0.0037 0.0034
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0037 0.0065
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0268 0.0981
Brugia malayi chromobox protein homolog 3 0.0043 0.0892 0.1571
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0014 0.0146 0.0143
Echinococcus multilocularis thyroid hormone receptor alpha 0.0133 0.3225 0.3223
Loa Loa (eye worm) hypothetical protein 0.0013 0.0105 0.018
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0046 0.0976 0.9923
Loa Loa (eye worm) hypothetical protein 0.001 0.0037 0.006
Entamoeba histolytica hypothetical protein 0.0035 0.068 1
Toxoplasma gondii exonuclease III APE 0.0019 0.0267 0.0299
Echinococcus multilocularis chromobox protein 1 0.0077 0.1763 0.176
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0015 0.0181 0.0455
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0019 0.0267 0.2817
Loa Loa (eye worm) hypothetical protein 0.0013 0.0105 0.018
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0016 0.0192 0.0526
Brugia malayi Heterochromatin protein 1 0.0077 0.1763 0.3105
Echinococcus multilocularis leucyl aminopeptidase 0.0044 0.0923 0.092
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0037 0.0034
Schistosoma mansoni hypothetical protein 0.0035 0.068 0.0645
Brugia malayi hypothetical protein 0.0013 0.0105 0.0185
Brugia malayi SET domain containing protein 0.0013 0.0121 0.0213
Brugia malayi CXXC zinc finger family protein 0.0028 0.0498 0.0878
Trichomonas vaginalis conserved hypothetical protein 0.0043 0.0892 0.4746
Trichomonas vaginalis chromobox protein, putative 0.0046 0.0976 0.5254
Echinococcus granulosus chromodomain helicase DNA binding protein 1 0.0013 0.0105 0.0102
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0037 0.0034
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0014 0.0146 0.011
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0037 0.0034
Schistosoma mansoni cpg binding protein 0.0029 0.0539 0.0504
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0037 0.006
Plasmodium falciparum M17 leucyl aminopeptidase 0.0222 0.5511 1
Trypanosoma cruzi cytosolic leucyl aminopeptidase, putative 0.0222 0.5511 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0037 0.0065
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0037 0.0065
Echinococcus multilocularis cpg binding protein 0.0029 0.0539 0.0537
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0037 0.0065
Loa Loa (eye worm) aminopeptidase in chromosome V 0.0044 0.0923 0.1621
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MF, Family M17 0.0044 0.0923 0.1251
Schistosoma mansoni hypothetical protein 0.0047 0.0983 0.095
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0037 0.0034
Loa Loa (eye worm) latrophilin receptor protein 2 0.0017 0.023 0.04
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0268 0.0981
Schistosoma mansoni chromobox protein 0.0013 0.0105 0.0069
Echinococcus granulosus chromobox protein 1 0.0077 0.1763 0.176
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0037 0.006
Schistosoma mansoni hypothetical protein 0.0038 0.075 0.0716
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0037 0.006
Trypanosoma cruzi metallo-peptidase, Clan MF, Family M17 0.0044 0.0923 0.1251
Schistosoma mansoni chromobox protein 0.0013 0.0105 0.0069
Schistosoma mansoni leucine aminopeptidase 0.0044 0.0923 0.0889
Loa Loa (eye worm) CHromoDomain protein family member 0.0014 0.0146 0.0253
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0037 0.0034
Echinococcus granulosus chromobox protein 2 0.0013 0.0105 0.0102
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0124 0.2969 0.2967
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0037 0.0034
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.0267 0.5
Onchocerca volvulus 0.0047 0.0983 1
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0267 0.0466
Schistosoma mansoni hypothetical protein 0.0017 0.023 0.0193
Mycobacterium tuberculosis Probable aminopeptidase PepB 0.0222 0.5511 1
Loa Loa (eye worm) heterochromatin protein 1 0.0077 0.1763 0.3102
Echinococcus multilocularis chromobox protein 2 0.0013 0.0105 0.0102
Echinococcus granulosus Chromobox protein 3 0.0013 0.0105 0.0102
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.068 0.0645
Trichomonas vaginalis conserved hypothetical protein 0.0043 0.0892 0.4746
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0268 0.0981
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0037 0.0034
Schistosoma mansoni hypothetical protein 0.0017 0.023 0.0193
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0037 0.006
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0017 0.023 0.0404
Echinococcus multilocularis GPCR, family 2 0.0017 0.023 0.0227
Trypanosoma cruzi metallo-peptidase, Clan MF, Family M17 0.0044 0.0923 0.1251

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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