Detailed information for compound 725754

Basic information

Technical information
  • TDR Targets ID: 725754
  • Name: 4-[4-(2-quinolin-8-yloxyethoxy)phenyl]butan-2 -one
  • MW: 335.396 | Formula: C21H21NO3
  • H donors: 0 H acceptors: 2 LogP: 3.74 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)CCc1ccc(cc1)OCCOc1cccc2c1nccc2
  • InChi: 1S/C21H21NO3/c1-16(23)7-8-17-9-11-19(12-10-17)24-14-15-25-20-6-2-4-18-5-3-13-22-21(18)20/h2-6,9-13H,7-8,14-15H2,1H3
  • InChiKey: RDSQEGIVFXCMPH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-[4-[2-(8-quinolyloxy)ethoxy]phenyl]butan-2-one
  • ZINC04843055

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
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0108 0.1143 0.1143
Echinococcus multilocularis high affinity choline transporter 1 0.0384 0.5832 1
Schistosoma mansoni tar DNA-binding protein 0.0195 0.2628 0.4506
Trichomonas vaginalis glucosylceramidase, putative 0.019 0.2538 0.6002
Entamoeba histolytica hypothetical protein 0.0074 0.0571 1
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0183 0.2414 0.4139
Echinococcus multilocularis tar DNA binding protein 0.0195 0.2628 0.4506
Schistosoma mansoni hypothetical protein 0.0115 0.1264 0.2168
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0184 0.2438 0.418
Trichomonas vaginalis glucosylceramidase, putative 0.019 0.2538 0.6002
Trypanosoma brucei mitochondrial DNA polymerase beta 0.063 1 1
Schistosoma mansoni tar DNA-binding protein 0.0195 0.2628 0.4506
Trichomonas vaginalis glucosylceramidase, putative 0.029 0.4229 1
Schistosoma mansoni eyes absent homolog 0.0103 0.1061 0.1819
Loa Loa (eye worm) hypothetical protein 0.0384 0.5832 1
Echinococcus multilocularis lysosomal alpha glucosidase 0.0183 0.2414 0.4139
Schistosoma mansoni high-affinity choline transporter 0.0384 0.5832 1
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.063 1 1
Echinococcus multilocularis sodium coupled monocarboxylate transporter 1 0.0042 0.0031 0.0053
Schistosoma mansoni ap endonuclease 0.006 0.0335 0.0575
Brugia malayi hypothetical protein 0.0074 0.0571 0.0979
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0364 0.5483 0.9401
Loa Loa (eye worm) hypothetical protein 0.0052 0.019 0.0326
Schistosoma mansoni ap endonuclease 0.006 0.0335 0.0575
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0298 0.437 0.437
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.029 0.4229 0.7251
Trichomonas vaginalis glucosylceramidase, putative 0.019 0.2538 0.6002
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0089 0.0815 0.0815
Trichomonas vaginalis ap endonuclease, putative 0.006 0.0335 0.0793
Trichomonas vaginalis ap endonuclease, putative 0.006 0.0335 0.0793
Loa Loa (eye worm) hypothetical protein 0.0103 0.1061 0.1819
Trichomonas vaginalis glucosylceramidase, putative 0.029 0.4229 1
Onchocerca volvulus Glucosylceramidase homolog 0.019 0.2538 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0115 0.1264 0.2168
Plasmodium falciparum ataxin-2 like protein, putative 0.0052 0.019 0.5456
Loa Loa (eye worm) hypothetical protein 0.0364 0.5483 0.9401
Schistosoma mansoni hypothetical protein 0.0249 0.353 0.6053
Echinococcus granulosus histone acetyltransferase KAT2B 0.0045 0.0079 0.0136
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.029 0.4229 0.7251
Echinococcus granulosus lysosomal alpha glucosidase 0.0183 0.2414 0.4139
Trichomonas vaginalis glucosylceramidase, putative 0.019 0.2538 0.6002
Echinococcus granulosus sodium:glucose cotransporter 0.0042 0.0031 0.0053
Trichomonas vaginalis glucosylceramidase, putative 0.029 0.4229 1
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0154 0.1922 0.3295
Trichomonas vaginalis glucosylceramidase, putative 0.019 0.2538 0.6002
Trichomonas vaginalis glucosylceramidase, putative 0.029 0.4229 1
Entamoeba histolytica acetyltransferase, GNAT family 0.0041 0.0015 0.0268
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.063 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0184 0.2438 0.418
Echinococcus multilocularis solute carrier family 5 0.0042 0.0031 0.0053
Brugia malayi RNA binding protein 0.0195 0.2628 0.4506
Trichomonas vaginalis glucosylceramidase, putative 0.029 0.4229 1
Trichomonas vaginalis glucosylceramidase, putative 0.029 0.4229 1
Loa Loa (eye worm) TAR-binding protein 0.0195 0.2628 0.4506
Schistosoma mansoni alpha-glucosidase 0.0157 0.1982 0.3398
Echinococcus granulosus high affinity choline transporter 1 0.0384 0.5832 1
Toxoplasma gondii LsmAD domain-containing protein 0.0052 0.019 0.1834
Trypanosoma cruzi PAB1-binding protein , putative 0.0052 0.019 0.019
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0045 0.0079 0.0765
Loa Loa (eye worm) hypothetical protein 0.0042 0.0031 0.0053
Schistosoma mansoni alpha-glucosidase 0.0157 0.1982 0.3398
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.006 0.0335 0.0335
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0184 0.2438 0.418
Echinococcus multilocularis lysosomal alpha glucosidase 0.0183 0.2414 0.4139
Brugia malayi Glycosyl hydrolases family 31 protein 0.0183 0.2414 0.4139
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.006 0.0335 0.0335
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0115 0.1264 0.2168
Loa Loa (eye worm) acetyltransferase 0.0154 0.1922 0.3295
Leishmania major hypothetical protein, conserved 0.0052 0.019 0.019
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.006 0.0335 1
Entamoeba histolytica hypothetical protein 0.0074 0.0571 1
Schistosoma mansoni tar DNA-binding protein 0.0195 0.2628 0.4506
Brugia malayi exodeoxyribonuclease III family protein 0.006 0.0335 0.0575
Schistosoma mansoni hypothetical protein 0.0115 0.1264 0.2168
Trichomonas vaginalis glucosylceramidase, putative 0.02 0.2712 0.6412
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.006 0.0335 1
Loa Loa (eye worm) RNA binding protein 0.0195 0.2628 0.4506
Echinococcus granulosus GPCR family 2 0.0115 0.1264 0.2168
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0089 0.0815 0.0815
Brugia malayi hypothetical protein 0.0103 0.1061 0.1819
Brugia malayi TAR-binding protein 0.0195 0.2628 0.4506
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0045 0.0079 0.0187
Trypanosoma brucei PAB1-binding protein , putative 0.0052 0.019 0.019
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0154 0.1922 0.3295
Brugia malayi Latrophilin receptor protein 2 0.0115 0.1264 0.2168
Entamoeba histolytica hypothetical protein 0.0074 0.0571 1
Trichomonas vaginalis bromodomain-containing protein, putative 0.0045 0.0079 0.0187
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0184 0.2438 0.418
Toxoplasma gondii transporter, solute:sodium symporter (SSS) family protein 0.0042 0.0031 0.0297
Echinococcus granulosus histone acetyltransferase KAT2B 0.0149 0.1849 0.317
Treponema pallidum exodeoxyribonuclease (exoA) 0.006 0.0335 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.019 0.2538 0.6002
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0298 0.437 0.437
Plasmodium vivax ataxin-2 like protein, putative 0.0052 0.019 0.4321
Trichomonas vaginalis glucosylceramidase, putative 0.02 0.2712 0.6412
Toxoplasma gondii exonuclease III APE 0.006 0.0335 0.3238
Schistosoma mansoni hypothetical protein 0.0074 0.0571 0.0979
Brugia malayi GH02984p 0.0384 0.5832 1
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0298 0.437 0.437
Schistosoma mansoni transcription factor LCR-F1 0.0074 0.0571 0.0979
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0184 0.2438 0.418
Echinococcus granulosus sodium:glucose cotransporter 2 0.0042 0.0031 0.0053
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0045 0.0079 0.0765
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.006 0.0335 1
Schistosoma mansoni sodium/solute symporter 0.0042 0.0031 0.0053
Schistosoma mansoni tar DNA-binding protein 0.0195 0.2628 0.4506
Schistosoma mansoni hypothetical protein 0.0115 0.1264 0.2168
Brugia malayi acetyltransferase, GNAT family protein 0.0154 0.1922 0.3295
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0184 0.2438 0.418
Trichomonas vaginalis glucosylceramidase, putative 0.019 0.2538 0.6002
Brugia malayi RNA recognition motif domain containing protein 0.0195 0.2628 0.4506
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0115 0.1264 0.2168
Echinococcus granulosus sodium coupled monocarboxylate transporter 1 0.0042 0.0031 0.0053
Loa Loa (eye worm) hypothetical protein 0.0103 0.1061 0.1819
Schistosoma mansoni inositol transporter 0.0042 0.0031 0.0053
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0074 0.0571 0.0979
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0115 0.1264 0.2168
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.006 0.0335 0.0575
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.006 0.0335 0.0575
Echinococcus multilocularis sodium:glucose cotransporter 2 0.0042 0.0031 0.0053
Plasmodium falciparum ataxin-2 like protein, putative 0.0052 0.019 0.5456
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0364 0.5483 0.9401
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0074 0.0571 0.0979
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.006 0.0335 0.0335
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.006 0.0335 0.0575
Echinococcus multilocularis sodium:myo inositol cotransporter 0.0042 0.0031 0.0053
Echinococcus granulosus tar DNA binding protein 0.0195 0.2628 0.4506
Schistosoma mansoni inositol transporter 0.0042 0.0031 0.0053
Loa Loa (eye worm) hypothetical protein 0.0249 0.353 0.6053
Loa Loa (eye worm) hypothetical protein 0.0115 0.1264 0.2168
Echinococcus granulosus solute carrier family 5 0.0042 0.0031 0.0053
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0184 0.2438 0.418
Schistosoma mansoni hypothetical protein 0.0115 0.1264 0.2168
Loa Loa (eye worm) latrophilin receptor protein 2 0.0115 0.1264 0.2168
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.006 0.0335 0.5
Mycobacterium ulcerans hypothetical protein 0.0332 0.4942 1
Brugia malayi hypothetical protein 0.0052 0.019 0.0326
Schistosoma mansoni tar DNA-binding protein 0.0195 0.2628 0.4506
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0089 0.0815 0.0815
Entamoeba histolytica exodeoxyribonuclease III, putative 0.006 0.0335 0.5872
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0195 0.2628 0.4506
Trypanosoma cruzi PAB1-binding protein , putative 0.0052 0.019 0.019
Entamoeba histolytica hypothetical protein 0.0074 0.0571 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0332 0.4942 1
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0089 0.0815 0.0815
Brugia malayi latrophilin 2 splice variant baaae 0.0249 0.353 0.6053
Onchocerca volvulus 0.0106 0.1106 0.4288
Toxoplasma gondii hypothetical protein 0.0102 0.1036 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0364 0.5483 0.9401
Echinococcus multilocularis GPCR, family 2 0.0115 0.1264 0.2168
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0184 0.2438 0.418
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.006 0.0335 0.0335
Echinococcus granulosus sodium:myo inositol cotransporter 0.0042 0.0031 0.0053
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0115 0.1264 0.2168
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0184 0.2438 0.418
Brugia malayi Sodium:solute symporter family protein 0.0042 0.0031 0.0053

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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