Detailed information for compound 257738

Basic information

Technical information
  • TDR Targets ID: 257738
  • Name: 2-[4-(2-ethoxy-1-phenylethoxy)piperidin-1-yl] -6,7-dimethoxyquinazolin-4-amine
  • MW: 452.546 | Formula: C25H32N4O4
  • H donors: 1 H acceptors: 2 LogP: 3.75 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOCC(c1ccccc1)OC1CCN(CC1)c1nc(N)c2c(n1)cc(c(c2)OC)OC
  • InChi: 1S/C25H32N4O4/c1-4-32-16-23(17-8-6-5-7-9-17)33-18-10-12-29(13-11-18)25-27-20-15-22(31-3)21(30-2)14-19(20)24(26)28-25/h5-9,14-15,18,23H,4,10-13,16H2,1-3H3,(H2,26,27,28)
  • InChiKey: GSGULLVGUFGOCN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[4-(2-ethoxy-1-phenyl-ethoxy)-1-piperidyl]-6,7-dimethoxy-quinazolin-4-amine
  • 2-[4-(2-ethoxy-1-phenylethoxy)-1-piperidinyl]-6,7-dimethoxy-4-quinazolinamine
  • 2-[4-(2-ethoxy-1-phenyl-ethoxy)piperidin-1-yl]-6,7-dimethoxy-quinazolin-4-amine
  • [2-[4-(2-ethoxy-1-phenyl-ethoxy)piperidino]-6,7-dimethoxy-quinazolin-4-yl]amine
  • [2-[4-(2-ethoxy-1-phenyl-ethoxy)-1-piperidyl]-6,7-dimethoxy-quinazolin-4-yl]amine

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Adrenergic receptor alpha-1 Starlite/ChEMBL References

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
Trichomonas vaginalis tubulin gamma chain, putative 0.0188 0.3578 0.4712
Echinococcus granulosus tubulin gamma 1 chain 0.0188 0.3578 0.538
Entamoeba histolytica tubulin alpha chain, putative 0.0269 0.5227 0.5368
Trypanosoma cruzi zeta tubulin, putative 0.0082 0.1384 0.2007
Onchocerca volvulus 0.0107 0.1894 0.2399
Trichomonas vaginalis tubulin, putative 0.0107 0.1894 0.1814
Trypanosoma brucei alpha tubulin 0.0269 0.5227 0.784
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Trypanosoma brucei zeta tubulin, putative 0.0082 0.1384 0.2007
Plasmodium vivax tubulin epsilon chain, putative 0.0188 0.3578 0.5338
Trypanosoma brucei alpha tubulin, putative 0.0107 0.1894 0.2782
Schistosoma mansoni tubulin subunit beta 0.0338 0.665 1
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Brugia malayi hypothetical protein 0.0168 0.3154 0.4695
Schistosoma mansoni tubulin subunit delta 0.0082 0.1384 0.2008
Echinococcus granulosus alpha tubulin 0.0269 0.5227 0.786
Echinococcus granulosus Tubulin beta 2C chain 0.0338 0.665 1
Leishmania major beta tubulin 0.0338 0.665 1
Schistosoma mansoni tubulin subunit beta 0.0338 0.665 1
Trypanosoma brucei beta tubulin 0.0338 0.665 1
Brugia malayi Tubulin beta chain 0.0107 0.1894 0.2783
Plasmodium falciparum alpha tubulin 2 0.0269 0.5227 0.784
Loa Loa (eye worm) tubulin beta chain 0.0082 0.1384 0.2081
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Echinococcus granulosus tubulin alpha chain 0.0269 0.5227 0.786
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Trichomonas vaginalis tubulin beta chain, putative 0.0269 0.5227 0.7551
Brugia malayi CHE-14 protein 0.0055 0.084 0.1184
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Leishmania major beta tubulin 0.0338 0.665 1
Toxoplasma gondii beta tubulin 0.0338 0.665 1
Plasmodium vivax tubulin gamma chain, putative 0.0188 0.3578 0.5338
Loa Loa (eye worm) hypothetical protein 0.0055 0.0839 0.1262
Leishmania major delta tubulin, putative 0.0082 0.1384 0.2007
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0107 0.1894 0.1814
Trypanosoma cruzi zeta tubulin, putative 0.0082 0.1384 0.2007
Loa Loa (eye worm) hypothetical protein 0.0162 0.3033 0.4561
Echinococcus granulosus Tubulin alpha 1 chain 0.0269 0.5227 0.786
Schistosoma mansoni tubulin subunit alpha 0.0082 0.1384 0.2008
Loa Loa (eye worm) BEN-1 protein 0.0338 0.665 1
Trypanosoma brucei epsilon tubulin 0.0188 0.3578 0.5338
Trypanosoma brucei beta tubulin 0.0338 0.665 1
Loa Loa (eye worm) tubulin beta chain 0.0338 0.665 1
Echinococcus granulosus beta tubulin 0.0338 0.665 1
Leishmania major beta tubulin 0.0338 0.665 1
Echinococcus granulosus tubulin alpha 3 chain 0.0269 0.5227 0.786
Echinococcus granulosus tubulin alpha 3 chain 0.0269 0.5227 0.786
Plasmodium vivax tubulin alpha chain, putative 0.0269 0.5227 0.784
Leishmania major 3-hydroxy-3-methylglutaryl-CoA reductase 0.0135 0.247 0.3657
Leishmania major zeta tubulin, putative 0.0082 0.1384 0.2007
Leishmania major beta tubulin 0.0338 0.665 1
Echinococcus multilocularis beta tubulin 0.0338 0.665 1
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0187 0.3543 0.4652
Trichomonas vaginalis tubulin epsilon chain, putative 0.0269 0.5227 0.7551
Trichomonas vaginalis tubulin beta chain, putative 0.0269 0.5227 0.7551
Echinococcus multilocularis tubulin alpha chain 0.0269 0.5227 0.786
Echinococcus multilocularis hydroxymethylglutaryl coenzyme A reductase 0.0135 0.247 0.3715
Schistosoma mansoni patched 1 0.0055 0.084 0.1184
Toxoplasma gondii beta-1 tubulin, putative 0.0338 0.665 1
Trichomonas vaginalis tubulin beta chain, putative 0.0107 0.1894 0.1814
Trypanosoma brucei beta tubulin 0.0338 0.665 1
Trichomonas vaginalis tubulin beta chain, putative 0.0269 0.5227 0.7551
Brugia malayi Tubulin beta-1 chain 0.0338 0.665 1
Loa Loa (eye worm) tubulin alpha 2 0.008 0.1349 0.2029
Schistosoma mansoni tubulin subunit alpha 0.0269 0.5227 0.7841
Leishmania major beta tubulin 0.0338 0.665 1
Schistosoma mansoni tubulin subunit alpha 0.0269 0.5227 0.7841
Trichomonas vaginalis tubulin alpha chain, putative 0.0107 0.1894 0.1814
Leishmania major gamma-tubulin 0.0188 0.3578 0.5338
Schistosoma mansoni hypothetical protein 0.0188 0.3573 0.5331
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Trichomonas vaginalis tubulin beta chain, putative 0.0269 0.5227 0.7551
Echinococcus multilocularis tubulin epsilon chain 0.0188 0.3578 0.538
Trypanosoma cruzi tubulin delta chain 0.0082 0.1384 0.2007
Brugia malayi Animal haem peroxidase family protein 0.0087 0.1496 0.2179
Brugia malayi Cell division protein ftsZ 0.0082 0.1384 0.2008
Trypanosoma brucei alpha tubulin 0.0269 0.5227 0.784
Toxoplasma gondii alpha-tubulin I, putative 0.0269 0.5227 0.784
Giardia lamblia Epsilon tubulin 0.0082 0.1384 0.068
Loa Loa (eye worm) alpha-tubulin 0.0269 0.5227 0.786
Mycobacterium ulcerans hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase 0.0135 0.247 1
Trypanosoma brucei alpha tubulin 0.0269 0.5227 0.784
Echinococcus granulosus Tubulin beta 2C chain 0.0338 0.665 1
Echinococcus granulosus tubulin beta 4A class IVa 0.0338 0.665 1
Brugia malayi tubulin alpha-2 chain 0.0269 0.5227 0.7841
Loa Loa (eye worm) alpha-tubulin 0.0269 0.5227 0.786
Brugia malayi hypothetical protein 0.0087 0.1496 0.2179
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0082 0.1384 0.2007
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0269 0.5227 0.7551
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0135 0.247 0.3657
Echinococcus granulosus tubulin subunit TubB 0.0269 0.5227 0.786
Leishmania major beta tubulin 0.0338 0.665 1
Echinococcus granulosus tubulin alpha 0.0188 0.3578 0.538
Loa Loa (eye worm) animal heme peroxidase 0.0087 0.1496 0.225
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0082 0.1384 0.2007
Leishmania major beta tubulin 0.0338 0.665 1
Schistosoma mansoni alpha tubulin 0.0269 0.5227 0.7841
Trypanosoma brucei zeta tubulin 0.0082 0.1384 0.2007
Echinococcus multilocularis beta tubulin 0.0338 0.665 1
Trichomonas vaginalis tubulin beta-1 chain, putative 0.0082 0.1384 0.0935
Trichomonas vaginalis tubulin alpha chain, putative 0.0338 0.665 1
Loa Loa (eye worm) tubulin beta-1 chain 0.0338 0.665 1
Trichomonas vaginalis tubulin, putative 0.0082 0.1384 0.0935
Echinococcus multilocularis tubulin subunit beta 0.0338 0.665 1
Brugia malayi Hydroxymethylglutaryl-coenzyme A reductase family protein 0.0135 0.247 0.3657
Echinococcus granulosus peroxisome assembly protein 26 0.0269 0.5227 0.786
Echinococcus granulosus tubulin alpha chain 0.0269 0.5227 0.786
Echinococcus multilocularis Tubulin beta 2C chain 0.0338 0.665 1
Echinococcus multilocularis geminin 0.0188 0.3573 0.5374
Leishmania major beta tubulin 0.0338 0.665 1
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Trypanosoma cruzi epsilon tubulin, putative 0.0188 0.3578 0.5338
Schistosoma mansoni hydroxymethylglutaryl-CoA reductase (NADPH) 0.0135 0.247 0.3657
Echinococcus granulosus Tubulin beta 2C chain 0.0338 0.665 1
Echinococcus granulosus nuclear factor of activated T cells 5 0.0074 0.1225 0.1842
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Brugia malayi Tubulin alpha chain 0.0082 0.1384 0.2008
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Echinococcus granulosus sterol regulatory element binding protein 0.0055 0.084 0.1264
Schistosoma mansoni tubulin subunit gamma 0.0188 0.3578 0.5338
Loa Loa (eye worm) hypothetical protein 0.0018 0.006 0.0091
Echinococcus multilocularis tubulin alpha chain 0.0269 0.5227 0.786
Loa Loa (eye worm) animal heme peroxidase 0.0087 0.1496 0.225
Plasmodium falciparum tubulin beta chain 0.0338 0.665 1
Trichomonas vaginalis tubulin, putative 0.0107 0.1894 0.1814
Trypanosoma brucei beta tubulin 0.0188 0.3578 0.5338
Entamoeba histolytica tubulin family protein 0.0338 0.665 1
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Entamoeba histolytica tubulin family protein 0.0338 0.665 1
Trichomonas vaginalis tubulin beta chain, putative 0.0269 0.5227 0.7551
Brugia malayi Animal haem peroxidase family protein 0.0087 0.1496 0.2179
Plasmodium falciparum tubulin gamma chain 0.0188 0.3578 0.5338
Leishmania major beta tubulin 0.0338 0.665 1
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase 0.0135 0.247 0.3657
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0055 0.0839 0.1182
Echinococcus granulosus tubulin beta 1 chain 0.0338 0.665 1
Brugia malayi Peroxidasin 0.0087 0.1496 0.2179
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Brugia malayi Tubulin alpha chain 0.0269 0.5227 0.7841
Trichomonas vaginalis tubulin epsilon chain, putative 0.0269 0.5227 0.7551
Schistosoma mansoni alpha tubulin 0.0269 0.5227 0.7841
Echinococcus granulosus GPCR family 2 0.0018 0.006 0.0091
Schistosoma mansoni tubulin subunit beta 0.0338 0.665 1
Trichomonas vaginalis conserved hypothetical protein 0.0082 0.1384 0.0935
Loa Loa (eye worm) latrophilin receptor protein 2 0.0018 0.006 0.0091
Echinococcus multilocularis Tubulin beta 2C chain 0.0338 0.665 1
Schistosoma mansoni alpha tubulin 0.0269 0.5227 0.7841
Brugia malayi Isocitrate dehydrogenase 0.0018 0.0061 0.0001
Loa Loa (eye worm) transcription factor SMAD2 0.0133 0.2429 0.3653
Brugia malayi alpha-tubulin 0.0269 0.5227 0.7841
Trichomonas vaginalis tubulin epsilon chain, putative 0.0338 0.665 1
Trypanosoma cruzi tubulin gamma chain 0.0188 0.3578 0.5338
Echinococcus multilocularis peroxidasin 0.0087 0.1496 0.225
Giardia lamblia Beta tubulin 0.0338 0.665 1
Toxoplasma gondii alpha tubulin TUBA1 0.0269 0.5227 0.784
Echinococcus granulosus Tubulin beta 2C chain 0.0338 0.665 1
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Loa Loa (eye worm) BEN-1 protein 0.0338 0.665 1
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Loa Loa (eye worm) tubulin alpha chain 0.0269 0.5227 0.786
Leishmania major beta tubulin 0.0338 0.665 1
Echinococcus multilocularis tubulin alpha chain 0.0269 0.5227 0.786
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0063 0.0999 0.0274
Brugia malayi isocitrate dehydrogenase 0.0018 0.0061 0.0001
Brugia malayi Animal haem peroxidase family protein 0.0087 0.1496 0.2179
Brugia malayi Animal haem peroxidase family protein 0.0087 0.1496 0.2179
Echinococcus granulosus tubulin epsilon chain 0.0188 0.3578 0.538
Echinococcus multilocularis GPCR, family 2 0.0018 0.006 0.0091
Echinococcus multilocularis tubulin gamma 1 chain 0.0188 0.3578 0.538
Trypanosoma cruzi beta tubulin, putative 0.0338 0.665 1
Schistosoma mansoni hypothetical protein 0.0188 0.3573 0.5331
Trichomonas vaginalis tubulin alpha chain, putative 0.0107 0.1894 0.1814
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Toxoplasma gondii beta-tubulin, putative 0.0338 0.665 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0055 0.0839 0.1262
Loa Loa (eye worm) isocitrate dehydrogenase 0.0018 0.0061 0.0092
Mycobacterium leprae cell division protein FtsZ 0.0082 0.1384 0.5
Trichomonas vaginalis tubulin alpha chain, putative 0.0188 0.3578 0.4712
Echinococcus multilocularis tubulin alpha chain 0.0269 0.5227 0.786
Schistosoma mansoni tubulin subunit beta 0.0338 0.665 1
Giardia lamblia Alpha-tubulin 0.0269 0.5227 0.7482
Echinococcus granulosus Niemann Pick C1 protein 0.0055 0.084 0.1264
Trypanosoma brucei epsilon tubulin 0.0188 0.3578 0.5338
Loa Loa (eye worm) alpha-tubulin isotype 2 0.0187 0.3543 0.5328
Echinococcus multilocularis tubulin alpha 0.0188 0.3578 0.538
Schistosoma mansoni peroxidasin 0.0087 0.1496 0.2179
Loa Loa (eye worm) tubulin alpha 2 0.0187 0.3543 0.5328
Echinococcus granulosus beta tubulin 0.0338 0.665 1
Echinococcus multilocularis Tubulin beta 2C chain 0.0338 0.665 1
Echinococcus multilocularis sterol regulatory element binding protein 0.0055 0.084 0.1264
Echinococcus multilocularis hypothetical protein 0.0269 0.5227 0.786
Trichomonas vaginalis tubulin alpha chain, putative 0.0107 0.1894 0.1814
Trypanosoma brucei beta tubulin 0.0338 0.665 1
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0063 0.0999 0.0274
Trypanosoma cruzi epsilon tubulin, putative 0.0188 0.3578 0.5338
Loa Loa (eye worm) blistered cuticle protein 3 0.0087 0.1496 0.225
Leishmania major beta tubulin 0.0338 0.665 1
Schistosoma mansoni tubulin subunit beta 0.0338 0.665 1
Trichomonas vaginalis conserved hypothetical protein 0.0082 0.1384 0.0935
Entamoeba histolytica tubulin alpha-1 chain 0.0269 0.5227 0.5368
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0018 0.0061 0.0001
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Brugia malayi Tubulin beta chain 0.0082 0.1384 0.2008
Brugia malayi Blistered cuticle protein 3 0.0087 0.1496 0.2179
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0061 0.0092
Brugia malayi beta-tubulin, identical 0.0338 0.665 1
Plasmodium vivax tubulin beta chain, putative 0.0338 0.665 1
Plasmodium falciparum alpha tubulin 1 0.0269 0.5227 0.784
Echinococcus granulosus hydroxymethylglutaryl coenzyme A reductase 0.0135 0.247 0.3715
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0055 0.084 0.1264
Echinococcus multilocularis protein patched 0.0055 0.084 0.1264
Schistosoma mansoni tubulin subunit alpha 0.0269 0.5227 0.7841
Loa Loa (eye worm) tubulin alpha-2 chain 0.0269 0.5227 0.786
Echinococcus multilocularis Tubulin alpha 1 chain 0.0269 0.5227 0.786
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0162 0.3033 0.3774
Brugia malayi latrophilin 2 splice variant baaae 0.0038 0.0479 0.0635
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0018 0.0061 0.0092
Loa Loa (eye worm) tubulin alpha chain 0.0269 0.5227 0.786
Echinococcus granulosus tubulin alpha chain 0.0269 0.5227 0.786
Echinococcus granulosus geminin 0.0188 0.3573 0.5374
Leishmania major beta tubulin 0.0338 0.665 1
Plasmodium falciparum tubulin epsilon chain, putative 0.0188 0.3578 0.5338
Leishmania major beta tubulin 0.0338 0.665 1
Echinococcus granulosus tubulin alpha chain 0.0269 0.5227 0.786
Trypanosoma brucei tubulin delta chain 0.0082 0.1384 0.2007
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0018 0.006 0.0091
Loa Loa (eye worm) hypothetical protein 0.0055 0.084 0.1264
Trichomonas vaginalis tubulin gamma chain, putative 0.0188 0.3578 0.4712
Trypanosoma cruzi tubulin delta chain 0.0082 0.1384 0.2007
Loa Loa (eye worm) tubulin beta-4 chain 0.0338 0.665 1
Loa Loa (eye worm) tubulin gamma chain 0.0188 0.3578 0.538
Echinococcus multilocularis tubulin alpha 3 chain 0.0269 0.5227 0.786
Echinococcus granulosus tubulin alpha chain 0.0269 0.5227 0.786
Echinococcus granulosus peroxidasin 0.0087 0.1496 0.225
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0063 0.0999 0.0274
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Loa Loa (eye worm) hypothetical protein 0.0135 0.247 0.3715
Trichomonas vaginalis tubulin gamma chain, putative 0.0338 0.665 1
Trichomonas vaginalis tubulin beta chain, putative 0.0269 0.5227 0.7551
Plasmodium vivax delta tubulin, putative 0.0082 0.1384 0.2007
Trypanosoma brucei tubulin gamma chain 0.0188 0.3578 0.5338
Brugia malayi Animal haem peroxidase family protein 0.0087 0.1496 0.2179
Echinococcus multilocularis Tubulin alpha 1 chain 0.0269 0.5227 0.786
Loa Loa (eye worm) MH2 domain-containing protein 0.0133 0.2429 0.3653
Echinococcus granulosus tubulin subunit beta 0.0338 0.665 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0061 0.0092
Echinococcus granulosus Tubulin alpha 1 chain 0.0269 0.5227 0.786
Leishmania major beta tubulin 0.0338 0.665 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0055 0.0839 0.1182
Echinococcus multilocularis peroxisome assembly protein 26 0.0269 0.5227 0.786
Leishmania major epsilon tubulin, putative 0.0188 0.3578 0.5338
Trichomonas vaginalis tubulin, putative 0.0338 0.665 1
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0338 0.665 1
Plasmodium falciparum tubulin delta chain, putative 0.0082 0.1384 0.2007
Giardia lamblia Alpha-tubulin 0.0269 0.5227 0.7482
Trichomonas vaginalis tubulin epsilon chain, putative 0.0338 0.665 1
Giardia lamblia Beta tubulin 0.0338 0.665 1
Schistosoma mansoni hypothetical protein 0.0038 0.0479 0.0635
Loa Loa (eye worm) animal heme peroxidase 0.0087 0.1496 0.225
Echinococcus multilocularis Tubulin beta 2C chain 0.0338 0.665 1
Trypanosoma cruzi alpha tubulin, putative 0.0269 0.5227 0.784
Brugia malayi MH2 domain containing protein 0.0133 0.2429 0.3595
Echinococcus multilocularis Tubulin alpha 1 chain 0.0269 0.5227 0.786
Schistosoma mansoni tubulin subunit beta 0.0082 0.1384 0.2008
Echinococcus multilocularis Niemann Pick C1 protein 0.0055 0.084 0.1264
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0018 0.006 0.0091
Loa Loa (eye worm) tubulin beta-2A chain 0.0338 0.665 1
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Leishmania major beta tubulin 0.0338 0.665 1
Trichomonas vaginalis tubulin beta chain, putative 0.0338 0.665 1
Schistosoma mansoni tubulin subunit beta 0.0338 0.665 1
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Echinococcus multilocularis tubulin alpha 1C chain 0.0269 0.5227 0.786
Mycobacterium tuberculosis Cell division protein FtsZ 0.0082 0.1384 1
Echinococcus granulosus tubulin alpha 1C chain 0.0269 0.5227 0.786
Giardia lamblia Beta tubulin 0.0338 0.665 1
Trypanosoma brucei 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0135 0.247 0.3657
Leishmania major beta tubulin 0.0338 0.665 1
Plasmodium vivax tubulin alpha chain, putative 0.0269 0.5227 0.784
Echinococcus multilocularis tubulin alpha 1C chain 0.0269 0.5227 0.786
Brugia malayi Tubulin alpha-2 chain 0.0269 0.5227 0.7841
Brugia malayi Tubulin gamma chain 0.0188 0.3578 0.5338
Loa Loa (eye worm) hypothetical protein 0.0187 0.3543 0.5328
Trichomonas vaginalis tubulin gamma chain, putative 0.0082 0.1384 0.0935
Trypanosoma brucei epsilon tubulin 0.0188 0.3578 0.5338
Giardia lamblia Gamma tubulin 0.0188 0.3578 0.4563
Echinococcus multilocularis tubulin alpha 3 chain 0.0269 0.5227 0.786
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0018 0.0061 0.0092
Trichomonas vaginalis tubulin epsilon chain, putative 0.0082 0.1384 0.0935
Brugia malayi tubulin alpha chain - mouse 0.0269 0.5227 0.7841
Schistosoma mansoni tubulin subunit epsilon 0.0188 0.3578 0.5338
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Trypanosoma brucei alpha tubulin 0.0269 0.5227 0.784
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Echinococcus granulosus Tubulin alpha 1 chain 0.0269 0.5227 0.786
Leishmania major beta tubulin 0.0338 0.665 1
Brugia malayi Tubulin alpha-2 chain 0.0269 0.5227 0.7841
Loa Loa (eye worm) hypothetical protein 0.0038 0.0479 0.072
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0188 0.3578 0.5338
Loa Loa (eye worm) hypothetical protein 0.0168 0.3154 0.4743
Giardia lamblia Delta tubulin 0.0082 0.1384 0.068
Leishmania major beta tubulin 0.0338 0.665 1
Echinococcus multilocularis protein dispatched 1 0.0055 0.084 0.1264
Echinococcus multilocularis tubulin delta chain 0.0082 0.1384 0.2081
Echinococcus multilocularis nuclear factor of activated T cells 5 0.0074 0.1225 0.1842
Loa Loa (eye worm) animal heme peroxidase 0.0087 0.1496 0.225
Echinococcus multilocularis tubulin subunit TubB 0.0269 0.5227 0.786
Echinococcus granulosus Tubulin beta 2C chain 0.0338 0.665 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0018 0.006 0.0091
Echinococcus granulosus Protein patched homolog 1 0.0055 0.084 0.1264
Leishmania major alpha tubulin 0.0269 0.5227 0.784
Echinococcus multilocularis tubulin beta 1 chain 0.0338 0.665 1
Echinococcus multilocularis tubulin alpha chain 0.0269 0.5227 0.786
Onchocerca volvulus 0.0168 0.3154 1
Schistosoma mansoni peroxidasin 0.0087 0.1496 0.2179
Loa Loa (eye worm) tubulin alpha-3 chain 0.0162 0.3033 0.4561
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0055 0.084 0.1184
Echinococcus granulosus tubulin delta chain 0.0082 0.1384 0.2081
Loa Loa (eye worm) tubulin alpha 2 0.0187 0.3543 0.5328
Wolbachia endosymbiont of Brugia malayi cell division protein FtsZ 0.0082 0.1384 0.5
Loa Loa (eye worm) beta-tubulin 0.0338 0.665 1
Loa Loa (eye worm) hypothetical protein 0.0087 0.1496 0.225
Echinococcus multilocularis isocitrate dehydrogenase 0.0018 0.0061 0.0092
Echinococcus granulosus tubulin alpha 1C chain 0.0269 0.5227 0.786
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0061 0.0092
Loa Loa (eye worm) hypothetical protein 0.0269 0.5227 0.786
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0018 0.006 0.0091
Echinococcus multilocularis Tubulin beta 2C chain 0.0338 0.665 1

Activities

Activity type Activity value Assay description Source Reference
Displacement (binding) < 50 % Binding affinity for alpha-2 adrenergic receptor by displacement of [3H]-clonidine at 10e-6 M from rat brain homogenate preparation; indicates less than 50% ChEMBL. 2894465
Displacement (binding) < 50 % Binding affinity for alpha-2 adrenergic receptor by displacement of [3H]-clonidine at 10e-6 M from rat brain homogenate preparation; indicates less than 50% ChEMBL. 2894465
Ki (binding) = 10 nM Binding affinity for alpha-1 adrenergic receptor by displacement of [3H]-prazosin from rat brain homogenate preparation ChEMBL. 2894465
Ki (binding) = 10 nM Binding affinity for alpha-1 adrenergic receptor by displacement of [3H]-prazosin from rat brain homogenate preparation ChEMBL. 2894465
Reduction (functional) = 19 % Antihypertensive activity in spontaneously hypertensive rats (SHR) at 5 mg/kg dose (po) after 6 h ChEMBL. 2894465
Reduction (functional) = 24 % Antihypertensive activity in spontaneously hypertensive rats (SHR) at 5 mg/kg dose (po) after 1 h ChEMBL. 2894465

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

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.