Detailed information for compound 261581

Basic information

Technical information
  • TDR Targets ID: 261581
  • Name: 1,2,3-trimethoxy-6-methylidene-9-methylsulfan yl-5H-cyclohepta[a]naphthalen-8-one
  • MW: 356.435 | Formula: C20H20O4S
  • H donors: 0 H acceptors: 1 LogP: 3.36 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1c2c(CC(=C)c3c2ccc(c(=O)c3)SC)cc(c1OC)OC
  • InChi: 1S/C20H20O4S/c1-11-8-12-9-16(22-2)19(23-3)20(24-4)18(12)13-6-7-17(25-5)15(21)10-14(11)13/h6-7,9-10H,1,8H2,2-5H3
  • InChiKey: FUYPJTCITNJHCZ-UHFFFAOYSA-N  


Substructure search Similarity search

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Synonyms

  • 1,2,3-trimethoxy-6-methylene-9-methylsulfanyl-5H-cyclohepta[a]naphthalen-8-one
  • 1,2,3-trimethoxy-6-methylene-9-(methylthio)-5H-cyclohepta[a]naphthalen-8-one
  • NSC648780
  • NCI60_016965
  • ANTINEOPLASTIC-648780

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Bos taurus Tubulin Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) tubulin alpha 2 Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania braziliensis alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126605 All targets in OG5_126605
Trichomonas vaginalis tubulin alpha-1 chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126605 All targets in OG5_126605
Cryptosporidium parvum alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma mansoni alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma mansoni tubulin subunit alpha Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis Tubulin alpha 1 chain Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus tubulin subunit TubB Get druggable targets OG5_126605 All targets in OG5_126605
Giardia lamblia Alpha-tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) tubulin alpha-2 chain Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania infantum alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Cryptosporidium hominis alpha-tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Brugia malayi Tubulin alpha-2 chain Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) alpha-tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) tubulin alpha 2 Get druggable targets OG5_126605 All targets in OG5_126605
Brugia malayi Tubulin alpha-2 chain Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus Tubulin alpha 1 chain Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) tubulin alpha 2 Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus tubulin alpha 3 chain Get druggable targets OG5_126605 All targets in OG5_126605
Plasmodium berghei alpha tubulin 1 Get druggable targets OG5_126605 All targets in OG5_126605
Trichomonas vaginalis tubulin alpha-1 chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis peroxisome assembly protein 26 Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) alpha-tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) tubulin alpha-3 chain Get druggable targets OG5_126605 All targets in OG5_126605
Trichomonas vaginalis tubulin beta chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis tubulin subunit TubB Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126605 All targets in OG5_126605
Neospora caninum tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis hypothetical protein Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania infantum alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Trichomonas vaginalis tubulin beta chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma mansoni alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Plasmodium falciparum alpha tubulin 2 Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) alpha-tubulin isotype 2 Get druggable targets OG5_126605 All targets in OG5_126605
Toxoplasma gondii alpha-tubulin I, putative Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Trichomonas vaginalis tubulin beta chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma japonicum ko:K07374 tubulin alpha, putative Get druggable targets OG5_126605 All targets in OG5_126605
Brugia malayi tubulin alpha chain - mouse Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania donovani alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis tubulin alpha 3 chain Get druggable targets OG5_126605 All targets in OG5_126605
Plasmodium knowlesi alpha-tubulin II, putative Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania mexicana alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Trypanosoma brucei alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma mansoni tubulin subunit alpha Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania braziliensis alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Trypanosoma brucei gambiense alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Plasmodium knowlesi alpha tubulin, putative Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus tubulin alpha 1C chain Get druggable targets OG5_126605 All targets in OG5_126605
Theileria parva Tubulin alpha chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Trichomonas vaginalis tubulin beta chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Plasmodium vivax tubulin alpha chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Entamoeba histolytica tubulin alpha-1 chain Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Plasmodium yoelii tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Trichomonas vaginalis tubulin epsilon chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma japonicum Tubulin alpha-1C chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Candida albicans cytoskeletal structural protein Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Trichomonas vaginalis tubulin alpha-1 chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus Tubulin alpha 1 chain Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma japonicum Tubulin alpha-1 chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Giardia lamblia Alpha-tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis tubulin alpha 3 chain Get druggable targets OG5_126605 All targets in OG5_126605
Trypanosoma congolense alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Babesia bovis tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Brugia malayi Tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma mansoni tubulin subunit alpha Get druggable targets OG5_126605 All targets in OG5_126605
Trypanosoma brucei alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Trypanosoma brucei alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Plasmodium yoelii Tubulin/FtsZ family, putative Get druggable targets OG5_126605 All targets in OG5_126605
Brugia malayi tubulin alpha-2 chain Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma japonicum ko:K07374 tubulin alpha, putative Get druggable targets OG5_126605 All targets in OG5_126605
Plasmodium vivax tubulin alpha chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Brugia malayi alpha-tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma japonicum Tubulin alpha chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Trichomonas vaginalis tubulin beta chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis tubulin alpha 1C chain Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma japonicum Tubulin alpha-2/alpha-4 chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Babesia bovis tubulin alpha chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Trypanosoma cruzi alpha tubulin, putative Get druggable targets OG5_126605 All targets in OG5_126605
Loa Loa (eye worm) tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis Tubulin alpha 1 chain Get druggable targets OG5_126605 All targets in OG5_126605
Trichomonas vaginalis tubulin beta chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania mexicana alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Schistosoma mansoni alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus peroxisome assembly protein 26 Get druggable targets OG5_126605 All targets in OG5_126605
Toxoplasma gondii alpha tubulin TUBA1 Get druggable targets OG5_126605 All targets in OG5_126605
Plasmodium berghei alpha tubulin 2 Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Plasmodium falciparum alpha tubulin 1 Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus Tubulin alpha 1 chain Get druggable targets OG5_126605 All targets in OG5_126605
Leishmania major alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Theileria parva tubulin alpha chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis tubulin alpha 1C chain Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus tubulin alpha chain Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus multilocularis Tubulin alpha 1 chain Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus tubulin alpha 1C chain Get druggable targets OG5_126605 All targets in OG5_126605
Trypanosoma brucei alpha tubulin Get druggable targets OG5_126605 All targets in OG5_126605
Entamoeba histolytica tubulin alpha chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Trichomonas vaginalis tubulin epsilon chain, putative Get druggable targets OG5_126605 All targets in OG5_126605
Echinococcus granulosus tubulin alpha 3 chain Get druggable targets OG5_126605 All targets in OG5_126605
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Tubulin beta-1 chain Tubulin   445 aa 429 aa 87.4 %
Toxoplasma gondii beta-tubulin, putative Tubulin   445 aa 430 aa 89.8 %
Trypanosoma brucei epsilon tubulin Tubulin   445 aa 443 aa 29.3 %
Schistosoma japonicum ko:K10389 tubulin gamma, putative Tubulin   445 aa 436 aa 34.2 %
Babesia bovis tubulin, putative Tubulin   445 aa 459 aa 21.1 %
Trypanosoma cruzi tubulin gamma chain Tubulin   445 aa 436 aa 33.5 %
Onchocerca volvulus Regulatory-associated protein of mTOR homolog Tubulin   445 aa 440 aa 38.4 %
Drosophila melanogaster gamma-Tubulin at 23C Tubulin   445 aa 439 aa 34.6 %
Plasmodium falciparum tubulin epsilon chain, putative Tubulin   445 aa 461 aa 27.8 %
Echinococcus multilocularis Tubulin beta 2C chain Tubulin   445 aa 428 aa 92.5 %
Onchocerca volvulus 1D304 homolog Tubulin   445 aa 433 aa 40.4 %
Cryptosporidium hominis gamma-tubulin Tubulin   445 aa 436 aa 37.6 %
Trypanosoma brucei epsilon tubulin Tubulin   445 aa 443 aa 29.3 %
Trichomonas vaginalis tubulin, putative Tubulin   445 aa 428 aa 80.8 %
Leishmania infantum gamma-tubulin Tubulin   445 aa 438 aa 34.2 %
Echinococcus granulosus tubulin alpha Tubulin   445 aa 440 aa 30.2 %
Trypanosoma brucei epsilon tubulin Tubulin   445 aa 443 aa 29.1 %
Trichomonas vaginalis tubulin beta chain, putative Tubulin   445 aa 428 aa 80.6 %
Plasmodium yoelii tubulin beta chain Tubulin   445 aa 445 aa 29.7 %
Neospora caninum hypothetical protein Tubulin   445 aa 430 aa 89.1 %
Dictyostelium discoideum gamma tubulin Tubulin   445 aa 429 aa 34.0 %
Brugia malayi Tubulin gamma chain Tubulin   445 aa 440 aa 31.8 %
Entamoeba histolytica tubulin family protein Tubulin   445 aa 429 aa 57.8 %
Echinococcus multilocularis tubulin gamma 1 chain Tubulin   445 aa 436 aa 34.4 %
Trypanosoma congolense tubulin gamma chain Tubulin   445 aa 436 aa 33.3 %
Theileria parva tubulin gamma chain, putative Tubulin   445 aa 420 aa 34.5 %
Entamoeba histolytica tubulin family protein Tubulin   445 aa 428 aa 56.3 %
Onchocerca volvulus Putative cytochrome c-type heme lyase Tubulin   445 aa 429 aa 87.4 %
Onchocerca volvulus Tubulin   445 aa 441 aa 31.7 %
Giardia lamblia Gamma tubulin Tubulin   445 aa 460 aa 32.4 %
Dictyostelium discoideum beta tubulin Tubulin   445 aa 432 aa 75.7 %
Neospora caninum tubulin alpha chain, putative Tubulin   445 aa 433 aa 30.9 %
Trichomonas vaginalis tubulin gamma chain, putative Tubulin   445 aa 415 aa 33.3 %
Plasmodium knowlesi tubulin gamma chain, putative Tubulin   445 aa 438 aa 33.3 %
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein Tubulin   445 aa 433 aa 30.7 %
Giardia lamblia Beta tubulin Tubulin   445 aa 428 aa 88.3 %
Echinococcus multilocularis Tubulin beta 2C chain Tubulin   445 aa 430 aa 93.7 %
Onchocerca volvulus 60S ribosomal protein L13 homolog Tubulin   445 aa 430 aa 91.4 %
Cryptosporidium parvum gamma tubulin Tubulin   445 aa 436 aa 37.6 %
Drosophila melanogaster beta-Tubulin at 60D Tubulin   445 aa 435 aa 90.6 %
Onchocerca volvulus Tubulin   445 aa 435 aa 39.5 %
Toxoplasma gondii beta tubulin Tubulin   445 aa 430 aa 89.1 %
Trypanosoma brucei tubulin gamma chain Tubulin   445 aa 436 aa 33.5 %
Leishmania mexicana gamma-tubulin Tubulin   445 aa 438 aa 34.2 %
Loa Loa (eye worm) BEN-1 protein Tubulin   445 aa 427 aa 57.1 %
Plasmodium knowlesi tubulin epsilon chain, putative Tubulin   445 aa 441 aa 29.0 %
Brugia malayi beta-tubulin, identical Tubulin   445 aa 430 aa 90.5 %
Entamoeba histolytica tubulin gamma chain Tubulin   445 aa 428 aa 33.2 %
Giardia lamblia Epsilon tubulin Tubulin   445 aa 442 aa 27.6 %
Echinococcus multilocularis tubulin, beta 4A class IVa Tubulin   445 aa 381 aa 71.1 %
Leishmania braziliensis gamma-tubulin Tubulin   445 aa 438 aa 34.2 %
Schistosoma mansoni tubulin subunit gamma Tubulin   445 aa 436 aa 33.7 %
Leishmania major gamma-tubulin Tubulin   445 aa 438 aa 34.0 %
Onchocerca volvulus Tubulin   445 aa 445 aa 36.2 %
Onchocerca volvulus Tubulin   445 aa 434 aa 39.9 %
Neospora caninum hypothetical protein Tubulin   445 aa 430 aa 89.8 %
Echinococcus granulosus tubulin beta 4A class IVa Tubulin   445 aa 381 aa 71.1 %
Trichomonas vaginalis tubulin epsilon chain, putative Tubulin   445 aa 428 aa 80.8 %
Loa Loa (eye worm) BEN-1 protein Tubulin   445 aa 427 aa 82.2 %
Toxoplasma gondii beta-1 tubulin, putative Tubulin   445 aa 430 aa 89.1 %
Giardia lamblia Beta tubulin Tubulin   445 aa 428 aa 88.3 %
Echinococcus multilocularis tubulin delta chain Tubulin   445 aa 461 aa 25.8 %
Plasmodium yoelii tubulin gamma chain Tubulin   445 aa 438 aa 33.1 %
Neospora caninum Beta-tubulin, related Tubulin   445 aa 446 aa 35.2 %
Echinococcus multilocularis tubulin alpha Tubulin   445 aa 443 aa 30.5 %
Schistosoma mansoni tubulin subunit epsilon Tubulin   445 aa 464 aa 31.7 %
Leishmania mexicana beta tubulin Tubulin   445 aa 429 aa 85.8 %
Onchocerca volvulus Tubulin   445 aa 427 aa 82.4 %
Plasmodium vivax tubulin epsilon chain, putative Tubulin   445 aa 444 aa 28.6 %
Leishmania donovani tubulin gamma chain Tubulin   445 aa 438 aa 34.2 %
Trypanosoma brucei gambiense gamma tubulin Tubulin   445 aa 436 aa 33.5 %
Echinococcus granulosus Tubulin beta 2C chain Tubulin   445 aa 430 aa 94.4 %
Echinococcus granulosus tubulin gamma 1 chain Tubulin   445 aa 436 aa 34.4 %
Leishmania major epsilon tubulin, putative Tubulin   445 aa 469 aa 30.9 %
Echinococcus granulosus beta tubulin Tubulin   445 aa 427 aa 82.2 %
Trichomonas vaginalis tubulin alpha chain, putative Tubulin   445 aa 428 aa 80.8 %
Trypanosoma brucei gambiense epsilon tubulin Tubulin   445 aa 443 aa 29.3 %
Babesia bovis tubulin gamma chain Tubulin   445 aa 441 aa 34.0 %
Loa Loa (eye worm) tubulin beta-1 chain Tubulin   445 aa 432 aa 88.0 %
Trypanosoma cruzi epsilon tubulin, putative Tubulin   445 aa 456 aa 31.4 %
Onchocerca volvulus Tubulin   445 aa 433 aa 40.0 %
Schistosoma mansoni tubulin subunit beta Tubulin   445 aa 430 aa 92.3 %
Trypanosoma congolense epsilon tubulin Tubulin   445 aa 464 aa 29.1 %
Schistosoma mansoni tubulin subunit beta Tubulin   445 aa 430 aa 95.8 %
Plasmodium berghei tubulin gamma chain, putative Tubulin   445 aa 438 aa 33.3 %
Leishmania braziliensis epsilon tubulin, putative Tubulin   445 aa 465 aa 30.1 %
Echinococcus granulosus Tubulin beta 2C chain Tubulin   445 aa 428 aa 92.3 %
Plasmodium berghei tubulin epsilon chain, putative Tubulin   445 aa 445 aa 29.4 %
Schistosoma japonicum Tubulin beta chain, putative Tubulin   445 aa 436 aa 96.3 %
Onchocerca volvulus Tubulin   445 aa 427 aa 49.9 %
Onchocerca volvulus Tubulin   445 aa 433 aa 39.0 %
Plasmodium vivax tubulin gamma chain, putative Tubulin   445 aa 438 aa 33.3 %
Leishmania infantum epsilon tubulin, putative Tubulin   445 aa 475 aa 30.3 %
Giardia lamblia Beta tubulin Tubulin   445 aa 428 aa 88.3 %
Onchocerca volvulus Putative methyltransferase KIAA1456 Tubulin   445 aa 426 aa 49.8 %
Trypanosoma cruzi epsilon tubulin, putative Tubulin   445 aa 456 aa 31.4 %
Onchocerca volvulus Tyrosine kinase homolog Tubulin   445 aa 434 aa 38.2 %
Neospora caninum hypothetical protein Tubulin   445 aa 430 aa 89.1 %
Loa Loa (eye worm) tubulin beta-2A chain Tubulin   445 aa 430 aa 91.4 %
Leishmania donovani epsilon tubulin, putative Tubulin   445 aa 475 aa 30.3 %
Plasmodium falciparum tubulin gamma chain Tubulin   445 aa 438 aa 32.9 %
Leishmania mexicana epsilon tubulin, putative Tubulin   445 aa 469 aa 30.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0017 0.0103 0.3406
Echinococcus granulosus Tubulin alpha 1 chain 0.0022 0.0208 0.0208
Trichomonas vaginalis tubulin beta chain, putative 0.0022 0.0208 0.6896
Plasmodium falciparum M1-family alanyl aminopeptidase 0.0026 0.0302 1
Brugia malayi TATA binding protein associated factor 0.0026 0.0302 0.0675
Echinococcus multilocularis tubulin alpha chain 0.0022 0.0208 0.0208
Trypanosoma brucei alpha tubulin 0.0022 0.0208 0.6896
Toxoplasma gondii alpha tubulin TUBA1 0.0022 0.0208 0.6896
Loa Loa (eye worm) tubulin alpha chain 0.0022 0.0208 0.0208
Plasmodium vivax tubulin alpha chain, putative 0.0022 0.0208 0.6896
Trichomonas vaginalis tubulin beta chain, putative 0.0022 0.0208 0.6896
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0026 0.0302 0.0302
Loa Loa (eye worm) alpha-tubulin 0.0022 0.0208 0.0208
Trichomonas vaginalis tubulin beta chain, putative 0.0022 0.0208 0.6896
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Loa Loa (eye worm) hypothetical protein 0.0026 0.0302 0.0302
Brugia malayi Peptidase family M1 containing protein 0.0026 0.0302 0.0675
Trichomonas vaginalis tubulin beta chain, putative 0.0022 0.0208 0.6896
Toxoplasma gondii aminopeptidase N, putative 0.0026 0.0302 1
Plasmodium falciparum alpha tubulin 1 0.0022 0.0208 0.6896
Loa Loa (eye worm) hypothetical protein 0.0026 0.0302 0.0302
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0026 0.0302 0.0302
Trypanosoma brucei alpha tubulin 0.0022 0.0208 0.6896
Brugia malayi Peptidase family M1 containing protein 0.0026 0.0302 0.0675
Echinococcus multilocularis peroxisome assembly protein 26 0.0022 0.0208 0.0208
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0026 0.0302 0.0302
Echinococcus granulosus tubulin alpha chain 0.0022 0.0208 0.0208
Echinococcus multilocularis tubulin alpha 1C chain 0.0022 0.0208 0.0208
Onchocerca volvulus 0.0026 0.0302 0.5
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.0026 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0103 0.0103
Loa Loa (eye worm) aminopeptidase N 0.0026 0.0302 0.0302
Echinococcus multilocularis tubulin alpha chain 0.0022 0.0208 0.0208
Loa Loa (eye worm) tubulin alpha-3 chain 0.0015 0.0071 0.0071
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.049 1 1
Giardia lamblia Alpha-tubulin 0.0022 0.0208 1
Trypanosoma brucei alpha tubulin 0.0022 0.0208 0.6896
Loa Loa (eye worm) leukotriene A4 hydrolase 0.049 1 1
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0026 0.0302 0.0302
Loa Loa (eye worm) alpha-tubulin 0.0022 0.0208 0.0208
Schistosoma mansoni tubulin subunit alpha 0.0022 0.0208 0.0208
Echinococcus granulosus tubulin alpha chain 0.0022 0.0208 0.0208
Echinococcus granulosus alpha tubulin 0.0022 0.0208 0.0208
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0026 0.0302 1
Echinococcus multilocularis tubulin alpha chain 0.0022 0.0208 0.0208
Entamoeba histolytica aminopeptidase, putative 0.0026 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0208 0.0208
Toxoplasma gondii aminopeptidase n, putative 0.0026 0.0302 1
Brugia malayi hypothetical protein 0.0026 0.0302 0.0675
Toxoplasma gondii alpha-tubulin I, putative 0.0022 0.0208 0.6896
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0026 0.0302 0.0302
Echinococcus granulosus tubulin alpha 3 chain 0.0022 0.0208 0.0208
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0026 0.0302 1
Entamoeba histolytica tubulin alpha chain, putative 0.0022 0.0208 0.6896
Schistosoma mansoni alpha tubulin 0.0022 0.0208 0.0208
Onchocerca volvulus 0.0026 0.0302 0.5
Loa Loa (eye worm) TATA binding protein associated factor 0.0026 0.0302 0.0302
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0026 0.0302 1
Echinococcus multilocularis aminopeptidase N 0.0026 0.0302 0.0302
Echinococcus granulosus Tubulin alpha 1 chain 0.0022 0.0208 0.0208
Mycobacterium ulcerans aminopeptidase N PepN 0.0026 0.0302 0.5
Brugia malayi Tubulin alpha chain 0.0022 0.0208 0.0466
Schistosoma mansoni tubulin subunit alpha 0.0022 0.0208 0.0208
Echinococcus multilocularis tubulin alpha chain 0.0022 0.0208 0.0208
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0026 0.0302 0.0302
Trypanosoma cruzi Aminopeptidase M1, putative 0.0026 0.0302 1
Echinococcus multilocularis leukotriene A 4 hydrolase 0.049 1 1
Brugia malayi Tubulin alpha-2 chain 0.0022 0.0208 0.0466
Echinococcus multilocularis tubulin alpha 3 chain 0.0022 0.0208 0.0208
Plasmodium falciparum alpha tubulin 2 0.0022 0.0208 0.6896
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0026 0.0302 0.0302
Echinococcus granulosus tubulin alpha 1C chain 0.0022 0.0208 0.0208
Brugia malayi tubulin alpha chain - mouse 0.0022 0.0208 0.0466
Giardia lamblia Alpha-tubulin 0.0022 0.0208 1
Loa Loa (eye worm) tubulin alpha 2 0.0017 0.0103 0.0103
Loa Loa (eye worm) tubulin alpha 2 0.0017 0.0103 0.0103
Mycobacterium ulcerans aminopeptidase N PepN 0.0026 0.0302 0.5
Trichomonas vaginalis tubulin beta chain, putative 0.0022 0.0208 0.6896
Trichomonas vaginalis tubulin beta chain, putative 0.0022 0.0208 0.6896
Loa Loa (eye worm) hypothetical protein 0.0015 0.0071 0.0071
Brugia malayi hypothetical protein 0.0225 0.4467 1
Echinococcus granulosus aminopeptidase N 0.0026 0.0302 0.0302
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Trichomonas vaginalis tubulin epsilon chain, putative 0.0022 0.0208 0.6896
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0026 0.0302 0.0302
Echinococcus multilocularis tubulin alpha 1C chain 0.0022 0.0208 0.0208
Schistosoma mansoni aminopeptidase A (M01 family) 0.0026 0.0302 0.0302
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0026 0.0302 1
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0026 0.0302 1
Schistosoma mansoni tubulin subunit alpha 0.0022 0.0208 0.0208
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0026 0.0302 0.0302
Echinococcus granulosus tubulin alpha chain 0.0022 0.0208 0.0208
Toxoplasma gondii aminopeptidase N protein 0.0026 0.0302 1
Echinococcus granulosus peroxisome assembly protein 26 0.0022 0.0208 0.0208
Trypanosoma cruzi alpha tubulin, putative 0.0022 0.0208 0.6896
Brugia malayi Peptidase family M1 containing protein 0.0026 0.0302 0.0675
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0022 0.0208 0.6896
Trypanosoma brucei Aminopeptidase M1, putative 0.0026 0.0302 1
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Brugia malayi alpha-tubulin 0.0022 0.0208 0.0466
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0026 0.0302 0.0302
Loa Loa (eye worm) alpha-tubulin isotype 2 0.0017 0.0103 0.0103
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0026 0.0302 1
Echinococcus multilocularis tubulin subunit TubB 0.0022 0.0208 0.0208
Echinococcus multilocularis Tubulin alpha 1 chain 0.0022 0.0208 0.0208
Echinococcus granulosus tubulin alpha 1C chain 0.0022 0.0208 0.0208
Trypanosoma brucei aminopeptidase, putative 0.0026 0.0302 1
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0026 0.0302 1
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Echinococcus multilocularis tubulin alpha 3 chain 0.0022 0.0208 0.0208
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0026 0.0302 1
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0026 0.0302 1
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0026 0.0302 1
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Echinococcus granulosus tubulin subunit TubB 0.0022 0.0208 0.0208
Schistosoma mansoni alpha tubulin 0.0022 0.0208 0.0208
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Leishmania major puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0026 0.0302 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0026 0.0302 0.0302
Schistosoma mansoni alpha tubulin 0.0022 0.0208 0.0208
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0026 0.0302 1
Loa Loa (eye worm) tubulin alpha chain 0.0022 0.0208 0.0208
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0015 0.0071 0.2348
Plasmodium vivax tubulin alpha chain, putative 0.0022 0.0208 0.6896
Echinococcus granulosus tubulin alpha 3 chain 0.0022 0.0208 0.0208
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0026 0.0302 1
Echinococcus granulosus tubulin alpha chain 0.0022 0.0208 0.0208
Echinococcus multilocularis Tubulin alpha 1 chain 0.0022 0.0208 0.0208
Loa Loa (eye worm) tubulin alpha-2 chain 0.0022 0.0208 0.0208
Trypanosoma cruzi aminopeptidase, putative 0.0026 0.0302 1
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0026 0.0302 0.0302
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0026 0.0302 0.0302
Echinococcus multilocularis hypothetical protein 0.0022 0.0208 0.0208
Echinococcus granulosus tubulin alpha chain 0.0022 0.0208 0.0208
Echinococcus multilocularis Tubulin alpha 1 chain 0.0022 0.0208 0.0208
Brugia malayi tubulin alpha-2 chain 0.0022 0.0208 0.0466
Loa Loa (eye worm) hypothetical protein 0.0026 0.0302 0.0302
Loa Loa (eye worm) peptidase family M1 containing protein 0.0026 0.0302 0.0302
Entamoeba histolytica tubulin alpha-1 chain 0.0022 0.0208 0.6896
Trypanosoma brucei alpha tubulin 0.0022 0.0208 0.6896
Brugia malayi hypothetical protein 0.0026 0.0302 0.0675
Trypanosoma brucei Aminopeptidase M1, putative 0.0026 0.0302 1
Onchocerca volvulus 0.0026 0.0302 0.5
Echinococcus multilocularis tubulin alpha chain 0.0022 0.0208 0.0208
Echinococcus granulosus Tubulin alpha 1 chain 0.0022 0.0208 0.0208
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0026 0.0302 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0022 0.0208 0.6896
Leishmania major alpha tubulin 0.0022 0.0208 0.6896
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0026 0.0302 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0026 0.0302 0.0302
Trypanosoma cruzi aminopeptidase, putative 0.0026 0.0302 1
Brugia malayi Tubulin alpha-2 chain 0.0022 0.0208 0.0466
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0026 0.0302 0.0302

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 0.084 nM Cytotoxicity against human melanoma RPMI-7951 cell line ChEMBL. 8496935
ED50 (functional) = 0.084 nM Cytotoxicity against human central nervous system carcinoma TE671 cell line ChEMBL. 8496935
ED50 (functional) = 0.084 nM Cytotoxicity against human melanoma RPMI-7951 cell line ChEMBL. 8496935
ED50 (functional) = 0.084 nM Cytotoxicity against human central nervous system carcinoma TE671 cell line ChEMBL. 8496935
ED50 (functional) = 22 nM Cytotoxicity against murine P388 leukemia cell line ChEMBL. 8496935
ED50 (functional) = 22 nM Cytotoxicity against murine P388 leukemia cell line ChEMBL. 8496935
ED50 (functional) = 140 nM Cytotoxicity against human solid tumor nasopharyngeal carcinoma KB cell line ChEMBL. 8496935
ED50 (functional) = 140 nM Cytotoxicity against human solid tumor nasopharyngeal carcinoma KB cell line ChEMBL. 8496935
ED50 (functional) = 196 nM Cytotoxicity against human solid tumor Colon carcinoma HCT-8 cell line ChEMBL. 8496935
ED50 (functional) = 196 nM Cytotoxicity against human solid tumor Colon carcinoma HCT-8 cell line ChEMBL. 8496935
ED50 (functional) = 252 nM Cytotoxicity against human solid tumor lung carcinoma A549 cell line ChEMBL. 8496935
ED50 (functional) = 252 nM Cytotoxicity against human solid tumor lung carcinoma A549 cell line ChEMBL. 8496935
GI50 (functional) -8 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) -8 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) -8 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) -8 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) -8 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) -8 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) -8 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) -7.184 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) -6.777 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
IC50 (functional) = 2.4 uM Inhibition of tubulin polymerization with preincubation for 15 minutes at 37 degree centigrade prior to addition of the GTP required for polymerization ChEMBL. 8496935
IC50 (functional) = 2.4 uM Inhibition of tubulin polymerization with preincubation for 15 minutes at 37 degree centigrade prior to addition of the GTP required for polymerization ChEMBL. 8496935
IC50 (functional) = 2.8 uM Evaluated for the inhibition of tubulin polymerization without preincubation ChEMBL. 8496935
IC50 (functional) = 2.8 uM Evaluated for the inhibition of tubulin polymerization without preincubation ChEMBL. 8496935
Inhibition (binding) = 91 % Percentage inhibition of [3H]-colchicine binding site on tubulin at 5 microM ChEMBL. 8496935
Inhibition (binding) = 91 % Percentage inhibition of [3H]-colchicine binding site on tubulin at 5 microM ChEMBL. 8496935
Stimulation (functional) = 233 % Evaluated for the stimulation of GTP hydrolysis ChEMBL. 8496935
Stimulation (functional) = 233 % Evaluated for the stimulation of GTP hydrolysis ChEMBL. 8496935

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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