Detailed information for compound 839235

Basic information

Technical information
  • TDR Targets ID: 839235
  • Name: N-(4-fluorophenyl)-3-(5-methylfuran-2-yl)prop -2-enamide
  • MW: 245.249 | Formula: C14H12FNO2
  • H donors: 1 H acceptors: 1 LogP: 2.78 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccc(cc1)F)C=Cc1ccc(o1)C
  • InChi: 1S/C14H12FNO2/c1-10-2-7-13(18-10)8-9-14(17)16-12-5-3-11(15)4-6-12/h2-9H,1H3,(H,16,17)/b9-8+
  • InChiKey: VLYORHNREQTXMS-CMDGGOBGSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (E)-N-(4-fluorophenyl)-3-(5-methylfuran-2-yl)prop-2-enamide
  • (E)-N-(4-fluorophenyl)-3-(5-methyl-2-furyl)prop-2-enamide
  • N-(4-fluorophenyl)-3-(5-methyl-2-furyl)prop-2-enamide
  • (E)-N-(4-fluorophenyl)-3-(5-methyl-2-furyl)acrylamide
  • N-(4-fluorophenyl)-3-(5-methyl-2-furyl)acrylamide
  • ZINC00433806
  • BIM-0020689.P001
  • CBMicro_020759

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 hypothetical protein 0.0071 0.0378 0.4325
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0028 0.0315
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0029 0.0094 0.0434
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0015 0.0001 0.0001
Toxoplasma gondii exonuclease III APE 0.0019 0.0028 0.0067
Loa Loa (eye worm) hypothetical protein 0.0029 0.0094 0.1071
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0029 0.0094 0.0094
Loa Loa (eye worm) hypothetical protein 0.0029 0.0094 0.1071
Schistosoma mansoni hypothetical protein 0.0333 0.2156 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0032 0.0114 0.1308
Mycobacterium tuberculosis Conserved protein 0.0032 0.0114 0.0281
Echinococcus granulosus ecdysone induced protein 78C 0.0029 0.0094 0.0434
Echinococcus granulosus beta LACTamase domain containing family member 0.0032 0.0114 0.053
Loa Loa (eye worm) beta-lactamase 0.0032 0.0114 0.1308
Brugia malayi MH2 domain containing protein 0.0114 0.0668 0.7656
Schistosoma mansoni retinoic acid receptor RXR 0.0029 0.0094 0.0434
Loa Loa (eye worm) hypothetical protein 0.0015 0.0001 0.0016
Loa Loa (eye worm) steroid hormone receptor 0.0029 0.0094 0.1071
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0028 0.5
Brugia malayi beta-lactamase 0.0032 0.0114 0.1308
Entamoeba histolytica hypothetical protein 0.0071 0.0378 1
Onchocerca volvulus 0.0144 0.0873 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.0508 0.2355
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.0028 0.0067
Entamoeba histolytica hypothetical protein 0.0071 0.0378 1
Mycobacterium tuberculosis Probable esterase LipL 0.0032 0.0114 0.0281
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0015 0 0.0001
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0028 0.0028
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.0028 0.5
Loa Loa (eye worm) hypothetical protein 0.0032 0.0114 0.1308
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0015 0 0.0001
Brugia malayi Steroid receptor seven-up type 2 0.0029 0.0094 0.1071
Mycobacterium ulcerans pantoate--beta-alanine ligase 0.0612 0.4053 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0029 0.0094 0.1071
Loa Loa (eye worm) hypothetical protein 0.0029 0.0094 0.1071
Loa Loa (eye worm) hypothetical protein 0.0032 0.0114 0.1308
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0028 0.2398
Brugia malayi Nuclear hormone receptor-like 1 0.0015 0.0001 0.0016
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.0508 0.2355
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0028 0.0128
Loa Loa (eye worm) isocitrate dehydrogenase 0.0015 0 0.0002
Loa Loa (eye worm) hypothetical protein 0.0015 0.0001 0.0016
Plasmodium vivax hypothetical protein, conserved 0.0032 0.0114 1
Entamoeba histolytica hypothetical protein 0.0071 0.0378 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0029 0.0094 0.1071
Brugia malayi steroid hormone receptor 0.0029 0.0094 0.1071
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0029 0.0094 0.0434
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0029 0.0094 0.0434
Brugia malayi Nuclear hormone receptor-like 1 0.0029 0.0094 0.1071
Onchocerca volvulus 0.0032 0.0114 0.0265
Leishmania major hypothetical protein, conserved 0.0032 0.0114 1
Mycobacterium ulcerans beta-lactamase 0.0032 0.0114 0.0215
Mycobacterium ulcerans hypothetical protein 0.0032 0.0114 0.0215
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0032 0.0114 0.0215
Echinococcus multilocularis geminin 0.0333 0.2156 0.2156
Brugia malayi Calcitonin receptor-like protein seb-1 0.0047 0.022 0.2518
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.0508 0.0508
Loa Loa (eye worm) hypothetical protein 0.0144 0.0873 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0029 0.0094 0.1071
Toxoplasma gondii ABC1 family protein 0.0032 0.0114 0.0281
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0028 0.2398
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0071 0.0378 0.1751
Echinococcus multilocularis FTZ F1 alpha 0.0029 0.0094 0.0094
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0032 0.0114 0.0281
Onchocerca volvulus 0.0032 0.0114 0.0265
Mycobacterium tuberculosis Conserved protein 0.0032 0.0114 0.0281
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0029 0.0094 0.0434
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0029 0.0094 0.1071
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0029 0.0094 0.1071
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0028 0.0315
Brugia malayi nuclear hormone receptor 0.0029 0.0094 0.1071
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0029 0.0094 0.1071
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0029 0.0094 0.0094
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0047 0.022 0.2518
Loa Loa (eye worm) hypothetical protein 0.0015 0.0001 0.0016
Schistosoma mansoni steroid hormone receptor ad4bp 0.0029 0.0094 0.0434
Loa Loa (eye worm) hypothetical protein 0.0029 0.0094 0.1071
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0015 0.0001 0.0016
Schistosoma mansoni transcription factor LCR-F1 0.0071 0.0378 0.1751
Brugia malayi nuclear receptor RXR 0.0015 0.0001 0.0016
Brugia malayi latrophilin 2 splice variant baaae 0.0032 0.0118 0.1353
Loa Loa (eye worm) hypothetical protein 0.0029 0.0094 0.1071
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.0508 0.2355
Loa Loa (eye worm) hypothetical protein 0.0047 0.022 0.2518
Brugia malayi nuclear receptor NHR-88 0.0029 0.0094 0.1071
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0029 0.0094 0.0434
Mycobacterium leprae Probable pantoate--beta-alanine ligase PanC (pantothenate synthetase) (pantoate activating enzyme) 0.0612 0.4053 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0029 0.0094 0.0434
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0029 0.0094 0.1071
Loa Loa (eye worm) hypothetical protein 0.0032 0.0114 0.1308
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0029 0.0094 0.0094
Brugia malayi hypothetical protein 0.0015 0.0001 0.0016
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0029 0.0094 0.1071
Schistosoma mansoni RAR-like nuclear receptor 0.0029 0.0094 0.0434
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.009 0.0508 0.5815
Brugia malayi photoreceptor-specific nuclear receptor 0.0029 0.0094 0.1071
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0029 0.0094 0.1071
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0028 0.2398
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0029 0.0094 0.1071
Entamoeba histolytica hypothetical protein 0.0071 0.0378 1
Brugia malayi Nuclear hormone receptor-like 1 0.0015 0.0001 0.0016
Loa Loa (eye worm) hypothetical protein 0.0032 0.0118 0.1353
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0029 0.0094 0.1071
Mycobacterium ulcerans lipase LipD 0.0032 0.0114 0.0215
Schistosoma mansoni ap endonuclease 0.0019 0.0028 0.0128
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.0508 0.0508
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0029 0.0094 0.0094
Brugia malayi Isocitrate dehydrogenase 0.0015 0 0.0002
Loa Loa (eye worm) MH2 domain-containing protein 0.0114 0.0668 0.7656
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0029 0.0094 0.0434
Trichomonas vaginalis esterase, putative 0.0032 0.0114 1
Onchocerca volvulus 0.0032 0.0114 0.0265
Schistosoma mansoni thyroid hormone receptor 0.0029 0.0094 0.0434
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0015 0.0001 0.0007
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0029 0.0094 0.0434
Brugia malayi beta-lactamase family protein 0.0032 0.0114 0.1308
Loa Loa (eye worm) hypothetical protein 0.0029 0.0094 0.1071
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0029 0.0094 0.0434
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.0028 0.5
Toxoplasma gondii pantoate-beta-alanine ligase 0.0612 0.4053 1
Trypanosoma cruzi hypothetical protein, conserved 0.0032 0.0114 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.009 0.0508 0.5815
Schistosoma mansoni hypothetical protein 0.0333 0.2156 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0032 0.0114 0.053
Brugia malayi isocitrate dehydrogenase 0.0015 0 0.0002
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0032 0.0114 0.1308
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0203 0.1278 0.3153
Trichomonas vaginalis D-aminoacylase, putative 0.0032 0.0114 1
Trypanosoma brucei hypothetical protein, conserved 0.0032 0.0114 1
Mycobacterium tuberculosis Probable lipase LipD 0.0032 0.0114 0.0281
Loa Loa (eye worm) transcription factor SMAD2 0.0114 0.0668 0.7656
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0029 0.0094 0.1071
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0028 0.2398
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.0508 0.2355
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0029 0.0094 0.1071
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0032 0.0114 0.0281
Loa Loa (eye worm) hypothetical protein 0.0029 0.0094 0.1071
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0029 0.0094 0.0434
Loa Loa (eye worm) hypothetical protein 0.0032 0.0114 0.1308
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0029 0.0094 0.1071
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0032 0.0114 0.053
Schistosoma mansoni hypothetical protein 0.0071 0.0378 0.1751
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.0508 0.2355
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0028 1
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0029 0.0094 0.0434
Loa Loa (eye worm) hypothetical protein 0.0015 0.0001 0.0016
Loa Loa (eye worm) hypothetical protein 0.0015 0.0001 0.0016
Loa Loa (eye worm) hypothetical protein 0.0032 0.0114 0.1308
Echinococcus multilocularis thyroid hormone receptor alpha 0.0029 0.0094 0.0094
Echinococcus granulosus geminin 0.0333 0.2156 1
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0028 0.2398
Schistosoma mansoni nuclear hormone receptor 0.0029 0.0094 0.0434
Brugia malayi ecdysteroid receptor 0.0029 0.0094 0.1071
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0071 0.0378 0.0378
Brugia malayi hypothetical protein 0.0144 0.0873 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0032 0.0114 1
Mycobacterium tuberculosis Pantoate--beta-alanine ligase PanC (pantothenate synthetase) (pantoate activating enzyme) 0.0612 0.4053 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0029 0.0094 0.1071
Echinococcus multilocularis ecdysone induced protein 78C 0.0029 0.0094 0.0094
Trichomonas vaginalis D-aminoacylase, putative 0.0032 0.0114 1
Trypanosoma cruzi hypothetical protein, conserved 0.0032 0.0114 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0029 0.0094 0.1071
Mycobacterium tuberculosis Probable lipase LipE 0.0032 0.0114 0.0281
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0032 0.0114 0.0281
Echinococcus multilocularis beta LACTamase domain containing family member 0.0032 0.0114 0.0114
Trichomonas vaginalis D-aminoacylase, putative 0.0032 0.0114 1
Schistosoma mansoni hypothetical protein 0.0032 0.0118 0.0548
Loa Loa (eye worm) hypothetical protein 0.0032 0.0114 0.1308
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0015 0.0001 0.0007
Schistosoma mansoni coup transcription factor 0.0029 0.0094 0.0434
Mycobacterium tuberculosis Conserved protein 0.0032 0.0114 0.0281
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0029 0.0094 0.0094
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0029 0.0094 0.1071
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0047 0.022 0.2518
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0029 0.0094 0.1071
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0029 0.0094 0.0434
Trichomonas vaginalis penicillin-binding protein, putative 0.0032 0.0114 1
Mycobacterium ulcerans esterase/lipase LipP 0.0032 0.0114 0.0215
Mycobacterium tuberculosis Probable hydrolase 0.0032 0.0114 0.0281
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0029 0.0094 0.1071
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0015 0.0001 0.0007
Schistosoma mansoni ap endonuclease 0.0019 0.0028 0.0128
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0029 0.0094 0.1071
Echinococcus granulosus FTZ F1 alpha 0.0029 0.0094 0.0434
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0029 0.0094 0.0434
Brugia malayi beta-lactamase family protein 0.0032 0.0114 0.1308
Loa Loa (eye worm) hypothetical protein 0.0029 0.0094 0.1071
Brugia malayi hypothetical protein 0.0015 0.0001 0.0016
Schistosoma mansoni thyroid hormone receptor 0.0029 0.0094 0.0434
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0029 0.0094 0.0094

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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