Detailed information for compound 158502

Basic information

Technical information
  • TDR Targets ID: 158502
  • Name: 4-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]an iline hydrochloride
  • MW: 323.814 | Formula: C17H22ClNO3
  • H donors: 1 H acceptors: 0 LogP: 4.48 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc(CNc2ccc(cc2)C)cc(c1OC)OC.Cl
  • InChi: 1S/C17H21NO3.ClH/c1-12-5-7-14(8-6-12)18-11-13-9-15(19-2)17(21-4)16(10-13)20-3;/h5-10,18H,11H2,1-4H3;1H
  • InChiKey: YNUQVPKYSQEUIO-UHFFFAOYSA-N  


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Synonyms

  • p-tolyl-(3,4,5-trimethoxybenzyl)amine hydrochloride
  • 151222-00-3
  • 4-Methyl-N-(3,4,5-trimethoxybenzyl)aniline hydrochloride
  • 4-Methyl-N-(3,4,5-trimethoxybenzyl) aniline Hydrochloride
  • NSC650764

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Trypanosoma cruzi trypanothione reductase, putative Curated by TDR Targets References
Bos taurus Tubulin Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Plasmodium yoelii thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium knowlesi glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium berghei thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium vivax glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Theileria parva thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma cruzi trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Neospora caninum Glutathione reductase, related Get druggable targets OG5_126785 All targets in OG5_126785
Candida albicans similar to S. cerevisiae GLR1 (YPL091W) glutathione oxidoreductase Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania infantum trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma brucei trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Brugia malayi glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus multilocularis thioredoxin glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Neospora caninum MGC84926 protein, related Get druggable targets OG5_126785 All targets in OG5_126785
Babesia bovis thiodoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Loa Loa (eye worm) thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma congolense trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania major trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium falciparum glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma brucei gambiense trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania braziliensis trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Cryptosporidium hominis thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Candida albicans similar to S. cerevisiae GLR1 (YPL091W) glutathione oxidoreductase Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania mexicana trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Brugia malayi Thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium yoelii glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium vivax thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania donovani trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium berghei glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Cryptosporidium parvum thioredoxin reductase 1 Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium knowlesi thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium falciparum thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Toxoplasma gondii thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr Get druggable targets OG5_126785 All targets in OG5_126785
Loa Loa (eye worm) glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma japonicum ko:K00384 thioredoxin reductase (NADPH) [EC1.8.1.9], putative Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus granulosus thioredoxin glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Leishmania major epsilon tubulin, putative Tubulin   85 aa 110 aa 28.2 %
Giardia lamblia Alpha-tubulin Tubulin   85 aa 86 aa 76.7 %
Onchocerca volvulus Putative cytochrome c-type heme lyase Tubulin   85 aa 80 aa 48.8 %
Trichomonas vaginalis tubulin beta chain, putative Tubulin   85 aa 86 aa 74.4 %
Loa Loa (eye worm) tubulin gamma chain Tubulin   85 aa 80 aa 37.5 %
Toxoplasma gondii alpha tubulin TUBA1 Tubulin   85 aa 86 aa 74.4 %
Giardia lamblia Beta tubulin Tubulin   85 aa 80 aa 52.5 %
Trichomonas vaginalis tubulin gamma chain, putative Tubulin   85 aa 80 aa 51.2 %
Leishmania braziliensis alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Onchocerca volvulus Putative methyltransferase KIAA1456 Tubulin   85 aa 87 aa 39.1 %
Loa Loa (eye worm) BEN-1 protein Tubulin   85 aa 80 aa 50.0 %
Plasmodium knowlesi alpha tubulin, putative Tubulin   85 aa 86 aa 72.1 %
Echinococcus multilocularis beta tubulin Tubulin   85 aa 80 aa 51.2 %
Leishmania braziliensis beta-tubulin Tubulin   85 aa 80 aa 50.0 %
Echinococcus granulosus Tubulin alpha 1 chain Tubulin   85 aa 86 aa 69.8 %
Schistosoma japonicum ko:K07374 tubulin alpha, putative Tubulin   85 aa 86 aa 83.7 %
Leishmania infantum epsilon tubulin, putative Tubulin   85 aa 110 aa 28.2 %
Plasmodium yoelii Tubulin/FtsZ family, putative Tubulin   85 aa 86 aa 72.1 %
Loa Loa (eye worm) tubulin alpha chain Tubulin   85 aa 86 aa 83.7 %
Schistosoma mansoni tubulin subunit alpha Tubulin   85 aa 86 aa 82.6 %
Candida albicans C terminus of beta-tubulin Tubulin   85 aa 80 aa 47.5 %
Echinococcus multilocularis Tubulin alpha 1 chain Tubulin   85 aa 86 aa 74.4 %
Echinococcus multilocularis tubulin subunit beta Tubulin   85 aa 80 aa 50.0 %
Leishmania infantum beta tubulin Tubulin   85 aa 80 aa 50.0 %
Entamoeba histolytica tubulin gamma chain Tubulin   85 aa 69 aa 39.1 %
Schistosoma japonicum ko:K07375 tubulin beta, putative Tubulin   85 aa 80 aa 50.0 %
Leishmania major gamma-tubulin Tubulin   85 aa 81 aa 39.5 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Onchocerca volvulus Tubulin   85 aa 86 aa 83.7 %
Leishmania mexicana alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Echinococcus granulosus beta tubulin Tubulin   85 aa 80 aa 50.0 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Neospora caninum hypothetical protein Tubulin   85 aa 80 aa 50.0 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Trichomonas vaginalis tubulin gamma chain, putative Tubulin   85 aa 90 aa 28.9 %
Leishmania braziliensis beta-tubulin Tubulin   85 aa 80 aa 50.0 %
Trichomonas vaginalis tubulin alpha chain, putative Tubulin   85 aa 80 aa 51.2 %
Loa Loa (eye worm) tubulin alpha-2 chain Tubulin   85 aa 86 aa 70.9 %
Plasmodium berghei tubulin beta chain, putative Tubulin   85 aa 80 aa 51.2 %
Plasmodium knowlesi tubulin epsilon chain, putative Tubulin   85 aa 82 aa 29.3 %
Echinococcus granulosus tubulin subunit TubB Tubulin   85 aa 74 aa 40.5 %
Schistosoma mansoni tubulin subunit alpha Tubulin   85 aa 86 aa 76.7 %
Leishmania braziliensis beta-tubulin Tubulin   85 aa 80 aa 50.0 %
Trichomonas vaginalis tubulin beta chain, putative Tubulin   85 aa 86 aa 74.4 %
Schistosoma mansoni tubulin subunit gamma Tubulin   85 aa 77 aa 40.3 %
Echinococcus multilocularis Tubulin beta 2C chain Tubulin   85 aa 80 aa 50.0 %
Candida albicans gamma tubulin-like protein Tubulin   85 aa 78 aa 32.1 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Schistosoma mansoni alpha tubulin Tubulin   85 aa 86 aa 76.7 %
Echinococcus granulosus tubulin alpha chain Tubulin   85 aa 86 aa 44.2 %
Onchocerca volvulus Eukaryotic translation initiation factor 2A homolog Tubulin   85 aa 80 aa 51.2 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Schistosoma japonicum Tubulin alpha chain, putative Tubulin   85 aa 86 aa 70.9 %
Theileria parva tubulin beta chain, putative Tubulin   85 aa 80 aa 52.5 %
Echinococcus granulosus alpha tubulin Tubulin   85 aa 78 aa 39.7 %
Echinococcus granulosus tubulin alpha chain Tubulin   85 aa 72 aa 43.1 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Theileria parva Tubulin alpha chain, putative Tubulin   85 aa 92 aa 67.4 %
Neospora caninum Beta-tubulin, related Tubulin   85 aa 83 aa 34.9 %
Onchocerca volvulus Tubulin   85 aa 86 aa 76.7 %
Onchocerca volvulus Regulatory-associated protein of mTOR homolog Tubulin   85 aa 86 aa 73.3 %
Leishmania mexicana beta tubulin Tubulin   85 aa 80 aa 50.0 %
Echinococcus granulosus tubulin alpha 1C chain Tubulin   85 aa 86 aa 86.0 %
Neospora caninum tubulin alpha chain, putative Tubulin   85 aa 87 aa 40.2 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Trypanosoma cruzi hypothetical protein Tubulin   85 aa 82 aa 24.4 %
Trypanosoma brucei beta tubulin Tubulin   85 aa 80 aa 52.5 %
Echinococcus multilocularis Tubulin alpha 1 chain Tubulin   85 aa 86 aa 75.6 %
Plasmodium berghei tubulin epsilon chain, putative Tubulin   85 aa 83 aa 30.1 %
Echinococcus granulosus Tubulin alpha 1 chain Tubulin   85 aa 86 aa 74.4 %
Echinococcus multilocularis tubulin gamma 1 chain Tubulin   85 aa 75 aa 41.3 %
Trichomonas vaginalis tubulin beta chain, putative Tubulin   85 aa 86 aa 74.4 %
Echinococcus granulosus Tubulin beta 2C chain Tubulin   85 aa 80 aa 51.2 %
Echinococcus granulosus Tubulin alpha 1 chain Tubulin   85 aa 86 aa 75.6 %
Echinococcus multilocularis tubulin alpha chain Tubulin   85 aa 86 aa 58.1 %
Echinococcus multilocularis tubulin, beta 4A class IVa Tubulin   85 aa 83 aa 49.4 %
Echinococcus multilocularis tubulin alpha Tubulin   85 aa 85 aa 37.6 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Plasmodium vivax tubulin gamma chain, putative Tubulin   85 aa 81 aa 35.8 %
Trypanosoma brucei beta tubulin Tubulin   85 aa 80 aa 52.5 %
Plasmodium knowlesi tubulin gamma chain, putative Tubulin   85 aa 81 aa 35.8 %
Schistosoma japonicum Tubulin alpha-1 chain, putative Tubulin   85 aa 86 aa 76.7 %
Leishmania donovani epsilon tubulin, putative Tubulin   85 aa 110 aa 28.2 %
Leishmania braziliensis alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Echinococcus granulosus tubulin alpha 1C chain Tubulin   85 aa 86 aa 77.9 %
Echinococcus multilocularis tubulin epsilon chain Tubulin   85 aa 100 aa 24.0 %
Echinococcus granulosus Tubulin beta 2C chain Tubulin   85 aa 80 aa 50.0 %
Trypanosoma congolense beta tubulin Tubulin   85 aa 80 aa 52.5 %
Plasmodium yoelii tubulin beta chain Tubulin   85 aa 80 aa 51.2 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Trichomonas vaginalis tubulin, putative Tubulin   85 aa 94 aa 30.9 %
Leishmania infantum beta-tubulin Tubulin   85 aa 80 aa 50.0 %
Schistosoma mansoni tubulin subunit beta Tubulin   85 aa 80 aa 50.0 %
Leishmania infantum alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Trypanosoma brucei gambiense alpha tubulin Tubulin   85 aa 86 aa 74.4 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Echinococcus granulosus tubulin alpha chain Tubulin   85 aa 86 aa 83.7 %
Echinococcus multilocularis Tubulin beta 2C chain Tubulin   85 aa 80 aa 51.2 %
Plasmodium falciparum tubulin beta chain Tubulin   85 aa 80 aa 51.2 %
Echinococcus granulosus tubulin alpha 3 chain Tubulin   85 aa 86 aa 80.2 %
Leishmania mexicana Tubulin   85 aa 80 aa 50.0 %
Entamoeba histolytica tubulin family protein Tubulin   85 aa 80 aa 48.8 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Cryptosporidium hominis alpha-tubulin Tubulin   85 aa 86 aa 68.6 %
Brugia malayi Tubulin beta-1 chain Tubulin   85 aa 80 aa 50.0 %
Loa Loa (eye worm) alpha-tubulin Tubulin   85 aa 86 aa 80.2 %
Schistosoma mansoni alpha tubulin Tubulin   85 aa 86 aa 82.6 %
Schistosoma mansoni tubulin subunit alpha Tubulin   85 aa 86 aa 83.7 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Echinococcus granulosus tubulin alpha chain Tubulin   85 aa 86 aa 44.2 %
Schistosoma japonicum Tubulin alpha-2/alpha-4 chain, putative Tubulin   85 aa 86 aa 82.6 %
Babesia bovis tubulin alpha chain, putative Tubulin   85 aa 86 aa 70.9 %
Leishmania infantum beta tubulin Tubulin   85 aa 80 aa 50.0 %
Echinococcus granulosus Tubulin beta 2C chain Tubulin   85 aa 80 aa 50.0 %
Loa Loa (eye worm) alpha-tubulin Tubulin   85 aa 93 aa 73.1 %
Loa Loa (eye worm) tubulin beta-1 chain Tubulin   85 aa 80 aa 48.8 %
Leishmania mexicana Tubulin   85 aa 86 aa 69.8 %
Entamoeba histolytica tubulin alpha-1 chain Tubulin   85 aa 86 aa 51.2 %
Leishmania donovani alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Plasmodium yoelii tubulin beta chain Tubulin   85 aa 83 aa 30.1 %
Onchocerca volvulus Tubulin   85 aa 80 aa 50.0 %
Trichomonas vaginalis tubulin beta chain, putative Tubulin   85 aa 80 aa 52.5 %
Brugia malayi Tubulin gamma chain Tubulin   85 aa 80 aa 37.5 %
Trypanosoma brucei gambiense beta tubulin Tubulin   85 aa 80 aa 52.5 %
Toxoplasma gondii alpha-tubulin I, putative Tubulin   85 aa 86 aa 60.5 %
Brugia malayi alpha-tubulin Tubulin   85 aa 86 aa 77.9 %
Loa Loa (eye worm) tubulin beta-2A chain Tubulin   85 aa 80 aa 50.0 %
Giardia lamblia Epsilon tubulin Tubulin   85 aa 112 aa 26.8 %
Echinococcus granulosus tubulin alpha 3 chain Tubulin   85 aa 86 aa 80.2 %
Leishmania braziliensis beta tubulin Tubulin   85 aa 80 aa 50.0 %
Trypanosoma brucei gambiense gamma tubulin Tubulin   85 aa 81 aa 39.5 %
Cryptosporidium parvum tubulin beta chain Tubulin   85 aa 80 aa 50.0 %
Drosophila melanogaster gamma-Tubulin at 23C Tubulin   85 aa 69 aa 39.1 %
Brugia malayi Tubulin alpha-2 chain Tubulin   85 aa 86 aa 61.6 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Schistosoma mansoni tubulin subunit beta Tubulin   85 aa 80 aa 51.2 %
Trypanosoma brucei epsilon tubulin Tubulin   85 aa 110 aa 23.6 %
Schistosoma mansoni tubulin subunit beta Tubulin   85 aa 80 aa 51.2 %
Trypanosoma brucei epsilon tubulin Tubulin   85 aa 110 aa 23.6 %
Leishmania donovani tubulin gamma chain Tubulin   85 aa 81 aa 39.5 %
Trypanosoma cruzi tubulin gamma chain Tubulin   85 aa 81 aa 39.5 %
Echinococcus granulosus Tubulin beta 2C chain Tubulin   85 aa 86 aa 50.0 %
Echinococcus multilocularis hypothetical protein Tubulin   85 aa 78 aa 39.7 %
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast trypanothione reductase, putative 492 aa 548 aa 21.5 %
Echinococcus multilocularis Tubulin beta 2C chain Tubulin   85 aa 80 aa 50.0 %
Brugia malayi Tubulin alpha chain Tubulin   85 aa 86 aa 83.7 %
Trypanosoma brucei tubulin gamma chain Tubulin   85 aa 81 aa 39.5 %
Echinococcus multilocularis hypothetical protein Tubulin   85 aa 69 aa 26.1 %
Echinococcus multilocularis tubulin alpha chain Tubulin   85 aa 86 aa 44.2 %
Cryptosporidium parvum gamma tubulin Tubulin   85 aa 78 aa 35.9 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Echinococcus granulosus tubulin gamma 1 chain Tubulin   85 aa 75 aa 41.3 %
Onchocerca volvulus 1D304 homolog Tubulin   85 aa 86 aa 81.4 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Giardia lamblia Beta tubulin Tubulin   85 aa 80 aa 52.5 %
Echinococcus multilocularis tubulin alpha 1C chain Tubulin   85 aa 86 aa 76.7 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Echinococcus granulosus tubulin alpha chain Tubulin   85 aa 86 aa 58.1 %
Dictyostelium discoideum gamma tubulin Tubulin   85 aa 84 aa 39.3 %
Plasmodium vivax tubulin beta chain, putative Tubulin   85 aa 80 aa 51.2 %
Theileria parva tubulin gamma chain, putative Tubulin   85 aa 99 aa 29.3 %
Brugia malayi beta-tubulin, identical Tubulin   85 aa 80 aa 50.0 %
Giardia lamblia Gamma tubulin Tubulin   85 aa 80 aa 32.5 %
Trypanosoma brucei alpha tubulin Tubulin   85 aa 86 aa 74.4 %
Echinococcus multilocularis Tubulin alpha 1 chain Tubulin   85 aa 86 aa 69.8 %
Loa Loa (eye worm) BEN-1 protein Tubulin   85 aa 83 aa 38.6 %
Echinococcus multilocularis tubulin alpha 3 chain Tubulin   85 aa 86 aa 80.2 %
Loa Loa (eye worm) beta-tubulin Tubulin   85 aa 86 aa 38.4 %
Leishmania mexicana epsilon tubulin, putative Tubulin   85 aa 110 aa 28.2 %
Loa Loa (eye worm) tubulin beta chain Tubulin   85 aa 80 aa 51.2 %
Entamoeba histolytica tubulin family protein Tubulin   85 aa 80 aa 47.5 %
Echinococcus granulosus beta tubulin Tubulin   85 aa 80 aa 51.2 %
Babesia bovis conserved hypothetical protein Tubulin   85 aa 73 aa 27.4 %
Brugia malayi Tubulin alpha-2 chain Tubulin   85 aa 86 aa 82.6 %
Trypanosoma cruzi beta tubulin, putative Tubulin   85 aa 80 aa 52.5 %
Trypanosoma brucei gambiense epsilon tubulin Tubulin   85 aa 110 aa 23.6 %
Dictyostelium discoideum hypothetical protein Tubulin   85 aa 86 aa 61.6 %
Loa Loa (eye worm) tubulin alpha chain Tubulin   85 aa 86 aa 82.6 %
Babesia bovis tubulin beta chain Tubulin   85 aa 80 aa 51.2 %
Onchocerca volvulus 60S ribosomal protein L13 homolog Tubulin   85 aa 80 aa 50.0 %
Trichomonas vaginalis tubulin beta chain, putative Tubulin   85 aa 86 aa 74.4 %
Trypanosoma congolense alpha tubulin Tubulin   85 aa 86 aa 74.4 %
Schistosoma mansoni tubulin subunit epsilon Tubulin   85 aa 98 aa 23.5 %
Schistosoma japonicum ko:K10391 tubulin epsilon, putative Tubulin   85 aa 96 aa 25.0 %
Echinococcus multilocularis tubulin alpha chain Tubulin   85 aa 86 aa 83.7 %
Plasmodium berghei alpha tubulin 2 Tubulin   85 aa 86 aa 72.1 %
Echinococcus granulosus tubulin beta 4A class IVa Tubulin   85 aa 83 aa 49.4 %
Candida albicans C terminus of beta-tubulin Tubulin   85 aa 80 aa 47.5 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Trichomonas vaginalis tubulin epsilon chain, putative Tubulin   85 aa 86 aa 74.4 %
Trypanosoma brucei alpha tubulin Tubulin   85 aa 86 aa 74.4 %
Neospora caninum hypothetical protein Tubulin   85 aa 80 aa 51.2 %
Schistosoma mansoni tubulin subunit beta Tubulin   85 aa 80 aa 50.0 %
Trichomonas vaginalis tubulin, putative Tubulin   85 aa 80 aa 51.2 %
Trypanosoma congolense tubulin gamma chain Tubulin   85 aa 81 aa 39.5 %
Loa Loa (eye worm) tubulin alpha-3 chain Tubulin   85 aa 84 aa 84.5 %
Echinococcus granulosus prohormone 4 Tubulin   85 aa 76 aa 23.7 %
Onchocerca volvulus Tubulin   85 aa 86 aa 70.9 %
Trypanosoma brucei beta tubulin Tubulin   85 aa 80 aa 52.5 %
Dictyostelium discoideum beta tubulin Tubulin   85 aa 80 aa 48.8 %
Babesia bovis tubulin alpha chain Tubulin   85 aa 86 aa 62.8 %
Trichomonas vaginalis tubulin epsilon chain, putative Tubulin   85 aa 80 aa 51.2 %
Dictyostelium discoideum alpha tubulin Tubulin   85 aa 86 aa 64.0 %
Cryptosporidium hominis beta-catenin-like repeat protein Tubulin   85 aa 80 aa 50.0 %
Giardia lamblia Beta tubulin Tubulin   85 aa 80 aa 52.5 %
Echinococcus multilocularis tubulin alpha chain Tubulin   85 aa 72 aa 43.1 %
Echinococcus multilocularis peroxisome assembly protein 26 Tubulin   85 aa 88 aa 33.0 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Trypanosoma brucei gambiense beta tubulin Tubulin   85 aa 80 aa 52.5 %
Plasmodium falciparum tubulin epsilon chain, putative Tubulin   85 aa 99 aa 23.2 %
Candida albicans cytoskeletal structural protein Tubulin   85 aa 86 aa 69.8 %
Plasmodium vivax tubulin alpha chain, putative Tubulin   85 aa 86 aa 72.1 %
Plasmodium knowlesi alpha-tubulin II, putative Tubulin   85 aa 86 aa 72.1 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Leishmania infantum alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Cryptosporidium parvum alpha tubulin Tubulin   85 aa 86 aa 68.6 %
Echinococcus multilocularis tubulin alpha chain Tubulin   85 aa 86 aa 44.2 %
Neospora caninum tubulin alpha chain Tubulin   85 aa 86 aa 74.4 %
Trypanosoma cruzi alpha tubulin, putative Tubulin   85 aa 86 aa 73.3 %
Leishmania braziliensis gamma-tubulin Tubulin   85 aa 81 aa 39.5 %
Echinococcus granulosus tubulin beta 1 chain Tubulin   85 aa 80 aa 48.8 %
Plasmodium berghei tubulin gamma chain, putative Tubulin   85 aa 81 aa 37.0 %
Plasmodium falciparum tubulin gamma chain Tubulin   85 aa 81 aa 35.8 %
Schistosoma mansoni alpha tubulin Tubulin   85 aa 86 aa 82.6 %
Schistosoma japonicum Tubulin alpha-1C chain, putative Tubulin   85 aa 86 aa 77.9 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Schistosoma japonicum ko:K07374 tubulin alpha, putative Tubulin   85 aa 86 aa 82.6 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Schistosoma mansoni tubulin subunit beta Tubulin   85 aa 80 aa 50.0 %
Schistosoma japonicum Tubulin beta chain, putative Tubulin   85 aa 80 aa 50.0 %
Toxoplasma gondii beta-tubulin, putative Tubulin   85 aa 80 aa 51.2 %
Trypanosoma cruzi hypothetical protein, conserved Tubulin   85 aa 76 aa 27.6 %
Trypanosoma brucei epsilon tubulin Tubulin   85 aa 110 aa 23.6 %
Echinococcus multilocularis beta tubulin Tubulin   85 aa 80 aa 50.0 %
Schistosoma japonicum Tubulin beta chain, putative Tubulin   85 aa 80 aa 50.0 %
Echinococcus granulosus peroxisome assembly protein 26 Tubulin   85 aa 88 aa 31.8 %
Brugia malayi tubulin alpha chain - mouse Tubulin   85 aa 86 aa 82.6 %
Echinococcus multilocularis tubulin alpha 1C chain Tubulin   85 aa 86 aa 86.0 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Trichomonas vaginalis tubulin beta chain, putative Tubulin   85 aa 86 aa 74.4 %
Onchocerca volvulus Tubulin   85 aa 86 aa 82.6 %
Schistosoma japonicum ko:K07375 tubulin beta, putative Tubulin   85 aa 80 aa 50.0 %
Trichomonas vaginalis tubulin beta-1 chain, putative Tubulin   85 aa 80 aa 51.2 %
Echinococcus multilocularis prohormone 4 Tubulin   85 aa 76 aa 23.7 %
Leishmania mexicana beta tubulin Tubulin   85 aa 80 aa 50.0 %
Babesia bovis tubulin gamma chain Tubulin   85 aa 83 aa 36.1 %
Plasmodium falciparum alpha tubulin 2 Tubulin   85 aa 86 aa 72.1 %
Echinococcus multilocularis Tubulin beta 2C chain Tubulin   85 aa 80 aa 50.0 %
Toxoplasma gondii beta-1 tubulin, putative Tubulin   85 aa 80 aa 51.2 %
Trichomonas vaginalis tubulin alpha-1 chain, putative Tubulin   85 aa 86 aa 74.4 %
Leishmania braziliensis epsilon tubulin, putative Tubulin   85 aa 109 aa 30.3 %
Echinococcus multilocularis tubulin alpha 3 chain Tubulin   85 aa 86 aa 80.2 %
Leishmania mexicana beta tubulin Tubulin   85 aa 80 aa 50.0 %
Plasmodium vivax tubulin epsilon chain, putative Tubulin   85 aa 86 aa 30.2 %
Theileria parva tubulin alpha chain, putative Tubulin   85 aa 86 aa 64.0 %
Plasmodium yoelii tubulin alpha chain Tubulin   85 aa 86 aa 72.1 %
Onchocerca volvulus Tubulin beta-1 chain homolog Tubulin   85 aa 80 aa 51.2 %
Candida albicans gamma tubulin-like protein Tubulin   85 aa 78 aa 32.1 %
Leishmania mexicana gamma-tubulin Tubulin   85 aa 81 aa 39.5 %
Trypanosoma brucei alpha tubulin Tubulin   85 aa 86 aa 74.4 %
Echinococcus granulosus Tubulin beta 2C chain Tubulin   85 aa 80 aa 50.0 %
Giardia lamblia Alpha-tubulin Tubulin   85 aa 86 aa 76.7 %
Echinococcus granulosus tubulin alpha Tubulin   85 aa 85 aa 37.6 %
Brugia malayi tubulin alpha-2 chain Tubulin   85 aa 86 aa 65.1 %
Schistosoma mansoni tubulin subunit beta Tubulin   85 aa 80 aa 50.0 %
Giardia lamblia Hypothetical protein Tubulin   85 aa 72 aa 27.8 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Schistosoma japonicum ko:K10389 tubulin gamma, putative Tubulin   85 aa 77 aa 40.3 %
Drosophila melanogaster beta-Tubulin at 60D Tubulin   85 aa 80 aa 48.8 %
Plasmodium vivax tubulin alpha chain, putative Tubulin   85 aa 86 aa 72.1 %
Echinococcus multilocularis tubulin subunit TubB Tubulin   85 aa 74 aa 40.5 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Onchocerca volvulus Tubulin   85 aa 80 aa 37.5 %
Cryptosporidium hominis gamma-tubulin Tubulin   85 aa 78 aa 35.9 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Leishmania infantum beta tubulin Tubulin   85 aa 80 aa 50.0 %
Onchocerca volvulus Tyrosine kinase homolog Tubulin   85 aa 86 aa 76.7 %
Trichomonas vaginalis tubulin alpha chain, putative Tubulin   85 aa 86 aa 44.2 %
Leishmania major beta tubulin Tubulin   85 aa 80 aa 50.0 %
Neospora caninum hypothetical protein Tubulin   85 aa 80 aa 51.2 %
Trichomonas vaginalis tubulin beta chain, putative Tubulin   85 aa 86 aa 74.4 %
Plasmodium yoelii tubulin gamma chain Tubulin   85 aa 81 aa 37.0 %
Plasmodium falciparum alpha tubulin 1 Tubulin   85 aa 86 aa 74.4 %
Echinococcus multilocularis tubulin beta 1 chain Tubulin   85 aa 80 aa 48.8 %
Trypanosoma brucei beta tubulin Tubulin   85 aa 80 aa 52.5 %
Entamoeba histolytica tubulin alpha chain, putative Tubulin   85 aa 86 aa 51.2 %
Trypanosoma brucei beta tubulin Tubulin   85 aa 80 aa 52.5 %
Echinococcus multilocularis solute carrier family 35 member e1 protein Tubulin   85 aa 75 aa 26.7 %
Onchocerca volvulus Tubulin beta-1 chain homolog Tubulin   85 aa 79 aa 43.0 %
Trichomonas vaginalis tubulin epsilon chain, putative Tubulin   85 aa 86 aa 74.4 %
Trypanosoma brucei alpha tubulin Tubulin   85 aa 86 aa 74.4 %
Leishmania major alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Leishmania mexicana alpha tubulin Tubulin   85 aa 86 aa 69.8 %
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein Tubulin   85 aa 87 aa 40.2 %
Trichomonas vaginalis tubulin gamma chain, putative Tubulin   85 aa 94 aa 30.9 %
Echinococcus granulosus tubulin epsilon chain Tubulin   85 aa 100 aa 24.0 %
Onchocerca volvulus Tubulin   85 aa 87 aa 40.2 %
Leishmania mexicana beta tubulin Tubulin   85 aa 80 aa 50.0 %
Echinococcus multilocularis Tubulin beta 2C chain Tubulin   85 aa 86 aa 50.0 %
Echinococcus granulosus tubulin subunit beta Tubulin   85 aa 80 aa 50.0 %
Loa Loa (eye worm) tubulin beta-4 chain Tubulin   85 aa 80 aa 51.2 %
Leishmania infantum gamma-tubulin Tubulin   85 aa 81 aa 39.5 %
Trichomonas vaginalis tubulin epsilon chain, putative Tubulin   85 aa 80 aa 52.5 %
Toxoplasma gondii beta tubulin Tubulin   85 aa 80 aa 50.0 %
Plasmodium berghei alpha tubulin 1 Tubulin   85 aa 86 aa 72.1 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0026 0.2495 0.153
Trypanosoma brucei alpha tubulin 0.0017 0.1139 0.1139
Trypanosoma brucei beta tubulin 0.0017 0.1139 0.1139
Entamoeba histolytica tubulin family protein 0.0017 0.1139 0.5
Trypanosoma brucei alpha tubulin 0.0017 0.1139 0.1139
Brugia malayi Tubulin gamma chain 0.0017 0.1139 0.1139
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0026 0.2495 0.153
Trichomonas vaginalis glutathione reductase, putative 0.0026 0.2495 1
Loa Loa (eye worm) alpha-tubulin 0.0017 0.1139 0.1139
Giardia lamblia NADH oxidase lateral transfer candidate 0.0026 0.2495 1
Trypanosoma brucei beta tubulin 0.0017 0.1139 0.1139
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0026 0.2495 0.153
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0019 0.1439 0.1439
Plasmodium falciparum thioredoxin reductase 0.0026 0.2495 0.153
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0026 0.2495 0.153
Loa Loa (eye worm) glutathione reductase 0.0076 1 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0026 0.2495 0.153
Trichomonas vaginalis tubulin alpha chain, putative 0.0017 0.1139 0.4566
Echinococcus multilocularis thioredoxin glutathione reductase 0.0076 1 1
Loa Loa (eye worm) BEN-1 protein 0.0017 0.1139 0.1139
Loa Loa (eye worm) thioredoxin reductase 0.0076 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.0017 0.1139 0.4566
Plasmodium vivax glutathione reductase, putative 0.0076 1 1
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0026 0.2495 0.153
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0026 0.2495 0.153
Trypanosoma brucei beta tubulin 0.0017 0.1139 0.1139
Brugia malayi tubulin alpha-2 chain 0.0017 0.1139 0.1139
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0026 0.2495 0.153
Plasmodium vivax thioredoxin reductase, putative 0.0076 1 1
Loa Loa (eye worm) alpha-tubulin 0.0017 0.1139 0.1139
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0026 0.2495 0.5
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0017 0.1139 0.4566
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0026 0.2495 0.5
Brugia malayi alpha-tubulin 0.0017 0.1139 0.1139
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0026 0.2495 0.2495
Plasmodium falciparum glutathione reductase 0.0076 1 1
Trichomonas vaginalis tubulin gamma chain, putative 0.0017 0.1139 0.4566
Trypanosoma brucei epsilon tubulin 0.0017 0.1139 0.1139
Loa Loa (eye worm) tubulin alpha chain 0.0017 0.1139 0.1139
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0019 0.1439 0.1439
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0026 0.2495 0.2495
Trichomonas vaginalis tubulin epsilon chain, putative 0.0017 0.1139 0.4566
Trichomonas vaginalis tubulin epsilon chain, putative 0.0017 0.1139 0.4566
Loa Loa (eye worm) tubulin beta-1 chain 0.0017 0.1139 0.1139
Brugia malayi Thioredoxin reductase 0.0076 1 1
Trypanosoma cruzi trypanothione reductase, putative 0.0076 1 1
Loa Loa (eye worm) beta-tubulin 0.0017 0.1139 0.1139
Entamoeba histolytica tubulin gamma chain 0.0017 0.1139 0.5
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0026 0.2495 0.5
Echinococcus granulosus thioredoxin glutathione reductase 0.0076 1 1
Trichomonas vaginalis mercuric reductase, putative 0.0026 0.2495 1
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0026 0.2495 0.2495
Plasmodium falciparum thioredoxin reductase 0.0076 1 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0026 0.2495 0.153
Treponema pallidum NADH oxidase 0.0026 0.2495 0.5
Plasmodium falciparum glutathione reductase 0.0026 0.2495 0.153
Loa Loa (eye worm) BEN-1 protein 0.0017 0.1139 0.1139
Trichomonas vaginalis tubulin beta chain, putative 0.0017 0.1139 0.4566
Trichomonas vaginalis tubulin beta chain, putative 0.0017 0.1139 0.4566
Trichomonas vaginalis tubulin, putative 0.0017 0.1139 0.4566
Trichomonas vaginalis tubulin gamma chain, putative 0.0017 0.1139 0.4566
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0026 0.2495 0.153
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0026 0.2495 0.153
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0026 0.2495 0.153
Toxoplasma gondii NADPH-glutathione reductase 0.0026 0.2495 0.153
Trypanosoma brucei alpha tubulin 0.0017 0.1139 0.1139
Entamoeba histolytica tubulin family protein 0.0017 0.1139 0.5
Trypanosoma brucei trypanothione reductase 0.0076 1 1
Brugia malayi Tubulin alpha chain 0.0017 0.1139 0.1139
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0026 0.2495 0.153
Trichomonas vaginalis tubulin epsilon chain, putative 0.0017 0.1139 0.4566
Loa Loa (eye worm) tubulin beta-4 chain 0.0017 0.1139 0.1139
Trichomonas vaginalis tubulin beta chain, putative 0.0017 0.1139 0.4566
Loa Loa (eye worm) hypothetical protein 0.0017 0.1139 0.1139
Loa Loa (eye worm) tubulin alpha chain 0.0017 0.1139 0.1139
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0026 0.2495 0.153
Trypanosoma brucei beta tubulin 0.0017 0.1139 0.1139
Brugia malayi Tubulin alpha-2 chain 0.0017 0.1139 0.1139
Loa Loa (eye worm) tubulin beta chain 0.0017 0.1139 0.1139
Brugia malayi Tubulin beta-1 chain 0.0017 0.1139 0.1139
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0026 0.2495 0.5
Loa Loa (eye worm) tubulin gamma chain 0.0017 0.1139 0.1139
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0026 0.2495 0.153
Trypanosoma brucei epsilon tubulin 0.0017 0.1139 0.1139
Brugia malayi Tubulin alpha-2 chain 0.0017 0.1139 0.1139
Brugia malayi beta-tubulin, identical 0.0017 0.1139 0.1139
Trypanosoma cruzi trypanothione reductase, putative 0.0026 0.2495 0.153
Trypanosoma brucei beta tubulin 0.0017 0.1139 0.1139
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0076 1 1
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0026 0.2495 0.153
Toxoplasma gondii thioredoxin reductase 0.0076 1 1
Loa Loa (eye worm) tubulin beta-2A chain 0.0017 0.1139 0.1139
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0026 0.2495 0.153
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0026 0.2495 0.5
Trichomonas vaginalis tubulin beta chain, putative 0.0017 0.1139 0.4566
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0026 0.2495 0.2495
Entamoeba histolytica tubulin alpha-1 chain 0.0017 0.1139 0.5
Trypanosoma brucei alpha tubulin 0.0017 0.1139 0.1139
Trichomonas vaginalis tubulin gamma chain, putative 0.0017 0.1139 0.4566
Brugia malayi tubulin alpha chain - mouse 0.0017 0.1139 0.1139
Onchocerca volvulus 0.001 0 0.5
Leishmania major trypanothione reductase 0.0076 1 1
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0026 0.2495 0.2495
Trichomonas vaginalis tubulin beta chain, putative 0.0017 0.1139 0.4566
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0026 0.2495 0.5
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0026 0.2495 0.153
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0026 0.2495 0.153
Trichomonas vaginalis tubulin epsilon chain, putative 0.0017 0.1139 0.4566
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0026 0.2495 0.5
Entamoeba histolytica tubulin alpha chain, putative 0.0017 0.1139 0.5
Loa Loa (eye worm) tubulin alpha-2 chain 0.0017 0.1139 0.1139
Trichomonas vaginalis tubulin beta chain, putative 0.0017 0.1139 0.4566
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0026 0.2495 0.153
Trypanosoma brucei epsilon tubulin 0.0017 0.1139 0.1139
Trypanosoma brucei tubulin gamma chain 0.0017 0.1139 0.1139
Trichomonas vaginalis tubulin alpha chain, putative 0.0017 0.1139 0.4566

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) < -8 Tested for cytotoxicity against M14 cell lines in melanoma ChEMBL. 8410995
GI50 (functional) = -7.88 Tested for cytotoxicity against CAKI-1 cell lines in renal cancer ChEMBL. 8410995
GI50 (functional) -7.117 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) = -7.05 Tested for cytotoxicity against HL-60 (TB) cell lines in leukemia ChEMBL. 8410995
GI50 (functional) = -7.03 Tested for cytotoxicity against DMS273 cell lines in small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = -7.01 Tested for cytotoxicity against ACHN cell lines in renal cancer ChEMBL. 8410995
GI50 (functional) = -7 Tested for cytotoxicity against K-562 cell lines in leukemia ChEMBL. 8410995
GI50 (functional) = -6.96 Tested for cytotoxicity against SW-620 cell lines in colon cancer ChEMBL. 8410995
GI50 (functional) = -6.95 Tested for cytotoxicity against RXF-393 cell lines in renal cancer ChEMBL. 8410995
GI50 (functional) = -6.88 Tested for cytotoxicity against SK-MEL-2 cell lines in melanoma ChEMBL. 8410995
GI50 (functional) = -6.71 Tested for cytotoxicity against OVCAR-3 cell lines in ovarian cancer ChEMBL. 8410995
GI50 (functional) = -6.69 Tested for cytotoxicity against NCI-H522 cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = -6.67 Tested for cytotoxicity against NCI-H460 cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = -6.67 Tested for cytotoxicity against COLO 205 cell lines in colon cancer ChEMBL. 8410995
GI50 (functional) -6.666 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) = -6.61 Tested for cytotoxicity against HCT-15 cell lines in colon cancer ChEMBL. 8410995
GI50 (functional) = -6.6 Tested for cytotoxicity against KM20L2 cell lines in colon cancer ChEMBL. 8410995
GI50 (functional) = -6.57 Tested for cytotoxicity against SK-OV-3 cell lines in ovarian cancer ChEMBL. 8410995
GI50 (functional) = -6.55 Tested for cytotoxicity against CCRF-CEM cell lines in leukemia ChEMBL. 8410995
GI50 (functional) = -6.55 Tested for cytotoxicity against HOP-62 cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = -6.53 Tested for cytotoxicity against SNB-19 cell lines in CNS cancer ChEMBL. 8410995
GI50 (functional) = -6.5 Tested for cytotoxicity against SF-539 cell lines in CNS cancer ChEMBL. 8410995
GI50 (functional) = -6.49 Tested for cytotoxicity against SF-295 cell lines in CNS cancer ChEMBL. 8410995
GI50 (functional) = -6.49 Tested for cytotoxicity against 786-0 cell lines in renal cancer ChEMBL. 8410995
GI50 (functional) = -6.48 Tested for cytotoxicity against U251 cell lines in CNS cancer ChEMBL. 8410995
GI50 (functional) = -6.48 Tested for cytotoxicity against M19-MEL cell lines in melanoma ChEMBL. 8410995
GI50 (functional) = -6.46 Tested for cytotoxicity against HT-29 cell lines in colon cancer ChEMBL. 8410995
GI50 (functional) -6.443 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) = -6.41 Tested for cytotoxicity against SNB-75 cell lines in CNS cancer ChEMBL. 8410995
GI50 (functional) = -6.39 Tested for cytotoxicity against NCI-H23 cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = -6.37 Tested for cytotoxicity against MOLT-4 cell lines in leukemia ChEMBL. 8410995
GI50 (functional) = -6.37 Tested for cytotoxicity against DMS114 cell lines in small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = -6.36 Tested for cytotoxicity against RPMI-8226 cell lines in leukemia ChEMBL. 8410995
GI50 (functional) = -6.33 Tested for cytotoxicity against XF 498 cell lines in CNS cancer ChEMBL. 8410995
GI50 (functional) = -6.33 Tested for cytotoxicity against MALME-3M cell lines in melanoma ChEMBL. 8410995
GI50 (functional) -6.326 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) = -6.3 Tested for cytotoxicity against NCI-H322M cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = -6.29 Tested for cytotoxicity against A549/ATCC cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = -6.24 Tested for cytotoxicity against DLD-1 cell lines in colon cancer ChEMBL. 8410995
GI50 (functional) = -6.24 Tested for cytotoxicity against HCT-116 cell lines in colon cancer ChEMBL. 8410995
GI50 (functional) = -6.24 Tested for cytotoxicity against UACC-62 cell lines in melanoma ChEMBL. 8410995
GI50 (functional) = -6.2 Tested for cytotoxicity against LXFL529 cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) -6.182 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) = -6.15 Tested for cytotoxicity against IGROV1 cell lines in ovarian cancer ChEMBL. 8410995
GI50 (functional) = -6.13 Tested for cytotoxicity against EKCX cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = -6.12 Tested for cytotoxicity against KM12 cell lines in colon cancer ChEMBL. 8410995
GI50 (functional) = -6.12 Tested for cytotoxicity against OVCAR-8 cell lines in ovarian cancer ChEMBL. 8410995
GI50 (functional) -6.093 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) = -6.08 Tested for cytotoxicity against UO-31 cell lines in renal cancer ChEMBL. 8410995
GI50 (functional) = -6.07 Tested for cytotoxicity against LOX IMVI cell lines in melanoma ChEMBL. 8410995
GI50 (functional) = -6.07 Tested for cytotoxicity against SN12C cell lines in renal cancer ChEMBL. 8410995
GI50 (functional) = -6.04 Tested for cytotoxicity against SF-268 cell lines in CNS cancer ChEMBL. 8410995
GI50 (functional) = -6.04 Tested for cytotoxicity against SK-MEL-5 cell lines in melanoma ChEMBL. 8410995
GI50 (functional) = -5.96 Tested for cytotoxicity against SNB-78 cell lines in CNS cancer ChEMBL. 8410995
GI50 (functional) = -5.87 Tested for cytotoxicity against OVCAR-5 cell lines in ovarian cancer ChEMBL. 8410995
GI50 (functional) -5.605 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5.476 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5.43 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) = -4.73 Tested for cytotoxicity against HOP-92 cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = -4.67 Tested for cytotoxicity against OVCAR-4 cell lines in ovarian cancer ChEMBL. 8410995
GI50 (functional) = -4.43 Tested for cytotoxicity against HOP-18 cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) > -4 Tested for cytotoxicity against UACC-257 cell lines in melanoma ChEMBL. 8410995
GI50 (functional) > -4 Tested for cytotoxicity against A498 cell lines in renal cancer ChEMBL. 8410995
GI50 (functional) > -4 Tested for cytotoxicity against TK-10 cell lines in renal cancer ChEMBL. 8410995
GI50 (functional) = 0.104 uM Tested for cytotoxicity against DMS 273 cell lines in small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = 0.104 uM Tested for cytotoxicity against DMS 273 cell lines in small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = 0.162 uM Tested for cytotoxicity against CAKI-1 cell lines in renal cancer ChEMBL. 8410995
GI50 (functional) = 0.162 uM Tested for cytotoxicity against CAKI-1 cell lines in renal cancer ChEMBL. 8410995
GI50 (functional) = 0.214 uM Tested for cytotoxicity against OVCAR-3 cell lines in ovarian cancer ChEMBL. 8410995
GI50 (functional) = 0.214 uM Tested for cytotoxicity against OVCAR-3 cell lines in ovarian cancer ChEMBL. 8410995
GI50 (functional) = 0.219 uM Tested for cytotoxicity against COLO 205 cell lines in colon cancer ChEMBL. 8410995
GI50 (functional) = 0.219 uM Tested for cytotoxicity against COLO 205 cell lines in colon cancer ChEMBL. 8410995
GI50 (functional) = 0.233 uM Tested for cytotoxicity against SF-295 cell lines in CNS cancer ChEMBL. 8410995
GI50 (functional) = 0.233 uM Tested for cytotoxicity against SF-295 cell lines in CNS cancer ChEMBL. 8410995
GI50 (functional) = 0.262 uM Tested for cytotoxicity against NCI-H522 cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = 0.262 uM Tested for cytotoxicity against NCI-H522 cell lines in non-small-cell lung cancer ChEMBL. 8410995
GI50 (functional) = 0.292 uM Tested for cytotoxicity against M14 cell lines in melanoma ChEMBL. 8410995
GI50 (functional) = 0.292 uM Tested for cytotoxicity against M14 cell lines in melanoma ChEMBL. 8410995
GI50 (functional) = 0.722 uM Tested for cytotoxicity against human cancer cell lines HL-60(TB) (leukemia) cell line. ChEMBL. 8410995
GI50 (functional) = 0.722 uM Tested for cytotoxicity against human cancer cell lines HL-60(TB) (leukemia) cell line. ChEMBL. 8410995
IC50 (functional) = 3.5 uM In vitro inhibition of bovine electrophoretically homogeneous tubulin polymerization. ChEMBL. 8410995
IC50 (functional) = 3.5 uM In vitro inhibition of bovine electrophoretically homogeneous tubulin polymerization. ChEMBL. 8410995
Log GI50 (functional) < -8 Tested for cytotoxicity against M14 cell lines in melanoma ChEMBL. 8410995
Log GI50 (functional) = -7.88 Tested for cytotoxicity against CAKI-1 cell lines in renal cancer ChEMBL. 8410995
Log GI50 (functional) = -7.05 Tested for cytotoxicity against HL-60 (TB) cell lines in leukemia ChEMBL. 8410995
Log GI50 (functional) = -7.03 Tested for cytotoxicity against DMS273 cell lines in small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) = -7.01 Tested for cytotoxicity against ACHN cell lines in renal cancer ChEMBL. 8410995
Log GI50 (functional) = -7 Tested for cytotoxicity against K-562 cell lines in leukemia ChEMBL. 8410995
Log GI50 (functional) = -6.96 Tested for cytotoxicity against SW-620 cell lines in colon cancer ChEMBL. 8410995
Log GI50 (functional) = -6.95 Tested for cytotoxicity against RXF-393 cell lines in renal cancer ChEMBL. 8410995
Log GI50 (functional) = -6.88 Tested for cytotoxicity against SK-MEL-2 cell lines in melanoma ChEMBL. 8410995
Log GI50 (functional) = -6.71 Tested for cytotoxicity against OVCAR-3 cell lines in ovarian cancer ChEMBL. 8410995
Log GI50 (functional) = -6.69 Tested for cytotoxicity against NCI-H522 cell lines in non-small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) = -6.67 Tested for cytotoxicity against NCI-H460 cell lines in non-small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) = -6.67 Tested for cytotoxicity against COLO 205 cell lines in colon cancer ChEMBL. 8410995
Log GI50 (functional) = -6.61 Tested for cytotoxicity against HCT-15 cell lines in colon cancer ChEMBL. 8410995
Log GI50 (functional) = -6.6 Tested for cytotoxicity against KM20L2 cell lines in colon cancer ChEMBL. 8410995
Log GI50 (functional) = -6.57 Tested for cytotoxicity against SK-OV-3 cell lines in ovarian cancer ChEMBL. 8410995
Log GI50 (functional) = -6.55 Tested for cytotoxicity against CCRF-CEM cell lines in leukemia ChEMBL. 8410995
Log GI50 (functional) = -6.55 Tested for cytotoxicity against HOP-62 cell lines in non-small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) = -6.53 Tested for cytotoxicity against SNB-19 cell lines in CNS cancer ChEMBL. 8410995
Log GI50 (functional) = -6.5 Tested for cytotoxicity against SF-539 cell lines in CNS cancer ChEMBL. 8410995
Log GI50 (functional) = -6.49 Tested for cytotoxicity against SF-295 cell lines in CNS cancer ChEMBL. 8410995
Log GI50 (functional) = -6.49 Tested for cytotoxicity against 786-0 cell lines in renal cancer ChEMBL. 8410995
Log GI50 (functional) = -6.48 Tested for cytotoxicity against U251 cell lines in CNS cancer ChEMBL. 8410995
Log GI50 (functional) = -6.48 Tested for cytotoxicity against M19-MEL cell lines in melanoma ChEMBL. 8410995
Log GI50 (functional) = -6.46 Tested for cytotoxicity against HT-29 cell lines in colon cancer ChEMBL. 8410995
Log GI50 (functional) = -6.41 Tested for cytotoxicity against SNB-75 cell lines in CNS cancer ChEMBL. 8410995
Log GI50 (functional) = -6.39 Tested for cytotoxicity against NCI-H23 cell lines in non-small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) = -6.37 Tested for cytotoxicity against MOLT-4 cell lines in leukemia ChEMBL. 8410995
Log GI50 (functional) = -6.37 Tested for cytotoxicity against DMS114 cell lines in small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) = -6.36 Tested for cytotoxicity against RPMI-8226 cell lines in leukemia ChEMBL. 8410995
Log GI50 (functional) = -6.33 Tested for cytotoxicity against XF 498 cell lines in CNS cancer ChEMBL. 8410995
Log GI50 (functional) = -6.33 Tested for cytotoxicity against MALME-3M cell lines in melanoma ChEMBL. 8410995
Log GI50 (functional) = -6.3 Tested for cytotoxicity against NCI-H322M cell lines in non-small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) = -6.29 Tested for cytotoxicity against A549/ATCC cell lines in non-small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) = -6.24 Tested for cytotoxicity against DLD-1 cell lines in colon cancer ChEMBL. 8410995
Log GI50 (functional) = -6.24 Tested for cytotoxicity against HCT-116 cell lines in colon cancer ChEMBL. 8410995
Log GI50 (functional) = -6.24 Tested for cytotoxicity against UACC-62 cell lines in melanoma ChEMBL. 8410995
Log GI50 (functional) = -6.2 Tested for cytotoxicity against LXFL529 cell lines in non-small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) = -6.15 Tested for cytotoxicity against IGROV1 cell lines in ovarian cancer ChEMBL. 8410995
Log GI50 (functional) = -6.13 Tested for cytotoxicity against EKCX cell lines in non-small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) = -6.12 Tested for cytotoxicity against KM12 cell lines in colon cancer ChEMBL. 8410995
Log GI50 (functional) = -6.12 Tested for cytotoxicity against OVCAR-8 cell lines in ovarian cancer ChEMBL. 8410995
Log GI50 (functional) = -6.08 Tested for cytotoxicity against UO-31 cell lines in renal cancer ChEMBL. 8410995
Log GI50 (functional) = -6.07 Tested for cytotoxicity against LOX IMVI cell lines in melanoma ChEMBL. 8410995
Log GI50 (functional) = -6.07 Tested for cytotoxicity against SN12C cell lines in renal cancer ChEMBL. 8410995
Log GI50 (functional) = -6.04 Tested for cytotoxicity against SF-268 cell lines in CNS cancer ChEMBL. 8410995
Log GI50 (functional) = -6.04 Tested for cytotoxicity against SK-MEL-5 cell lines in melanoma ChEMBL. 8410995
Log GI50 (functional) = -5.96 Tested for cytotoxicity against SNB-78 cell lines in CNS cancer ChEMBL. 8410995
Log GI50 (functional) = -5.87 Tested for cytotoxicity against OVCAR-5 cell lines in ovarian cancer ChEMBL. 8410995
Log GI50 (functional) = -4.73 Tested for cytotoxicity against HOP-92 cell lines in non-small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) = -4.67 Tested for cytotoxicity against OVCAR-4 cell lines in ovarian cancer ChEMBL. 8410995
Log GI50 (functional) = -4.43 Tested for cytotoxicity against HOP-18 cell lines in non-small-cell lung cancer ChEMBL. 8410995
Log GI50 (functional) > -4 Tested for cytotoxicity against UACC-257 cell lines in melanoma ChEMBL. 8410995
Log GI50 (functional) > -4 Tested for cytotoxicity against A498 cell lines in renal cancer ChEMBL. 8410995
Log GI50 (functional) > -4 Tested for cytotoxicity against TK-10 cell lines in renal cancer ChEMBL. 8410995

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.

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