TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 352.384 | Formula: C20H20N2O4
H donors: 1 H acceptors: 1 LogP: 2.9 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: COc1cc(cc(c1OC)OC)C(=O)c1ccn(c1)c1ccc(cc1)N
InChi: 1S/C20H20N2O4/c1-24-17-10-14(11-18(25-2)20(17)26-3)19(23)13-8-9-22(12-13)16-6-4-15(21)5-7-16/h4-12H,21H2,1-3H3
InChiKey: OIQCJIXFJXULMT-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	tubulin, beta 2B class IIb	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania mexicana	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma mansoni	tubulin subunit beta	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma mansoni	tubulin subunit beta	Get druggable targets OG5_126611	All targets in OG5_126611
Neospora caninum	hypothetical protein	Get druggable targets OG5_126611	All targets in OG5_126611
Brugia malayi	Tubulin beta-1 chain	Get druggable targets OG5_126611	All targets in OG5_126611
Loa Loa (eye worm)	tubulin beta chain	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania infantum	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania mexicana	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Plasmodium yoelii	tubulin beta chain	Get druggable targets OG5_126611	All targets in OG5_126611
Plasmodium falciparum	tubulin beta chain	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania mexicana	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Entamoeba histolytica	tubulin family protein	Get druggable targets OG5_126611	All targets in OG5_126611
Loa Loa (eye worm)	tubulin beta-4 chain	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus multilocularis	Tubulin beta 2C chain	Get druggable targets OG5_126611	All targets in OG5_126611
Trypanosoma brucei	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania infantum	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Trypanosoma cruzi	beta tubulin, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus granulosus	tubulin beta 1 chain	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma mansoni	tubulin subunit beta	Get druggable targets OG5_126611	All targets in OG5_126611
Loa Loa (eye worm)	beta-tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Trypanosoma brucei	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Cryptosporidium hominis	beta-catenin-like repeat protein	Get druggable targets OG5_126611	All targets in OG5_126611
Loa Loa (eye worm)	tubulin beta-2A chain	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus granulosus	Tubulin beta 2C chain	Get druggable targets OG5_126611	All targets in OG5_126611
Trypanosoma brucei gambiense	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma japonicum	ko:K07375 tubulin beta, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus multilocularis	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Brugia malayi	beta-tubulin, identical	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus multilocularis	tubulin subunit beta	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma japonicum	Tubulin beta-7 chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Loa Loa (eye worm)	tubulin beta-1 chain	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Trichomonas vaginalis	tubulin beta chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania infantum	beta-tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus granulosus	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania braziliensis	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus granulosus	Tubulin beta 2C chain	Get druggable targets OG5_126611	All targets in OG5_126611
Cryptosporidium parvum	tubulin beta chain	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma mansoni	tubulin subunit beta	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma japonicum	Tubulin beta-4 chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Plasmodium vivax	tubulin beta chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus granulosus	tubulin beta 4A class IVa	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus multilocularis	Tubulin beta 2C chain	Get druggable targets OG5_126611	All targets in OG5_126611
Trypanosoma brucei	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania braziliensis	beta-tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus granulosus	tubulin subunit beta	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma japonicum	Tubulin beta chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus granulosus	Tubulin beta 2C chain	Get druggable targets OG5_126611	All targets in OG5_126611
Trichomonas vaginalis	tubulin gamma chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania mexicana	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus granulosus	Tubulin beta 2C chain	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma japonicum	Tubulin beta chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Trypanosoma brucei gambiense	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus multilocularis	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Trichomonas vaginalis	tubulin epsilon chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Toxoplasma gondii	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Giardia lamblia	Beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus granulosus	Tubulin beta 2C chain	Get druggable targets OG5_126611	All targets in OG5_126611
Trichomonas vaginalis	tubulin alpha chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma japonicum	Tubulin beta-1 chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania braziliensis	beta-tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus multilocularis	Tubulin beta 2C chain	Get druggable targets OG5_126611	All targets in OG5_126611
Toxoplasma gondii	beta-tubulin, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Trypanosoma brucei	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania mexicana		Get druggable targets OG5_126611	All targets in OG5_126611
Neospora caninum	hypothetical protein	Get druggable targets OG5_126611	All targets in OG5_126611
Plasmodium berghei	tubulin beta chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Babesia bovis	tubulin beta chain	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma japonicum	Tubulin beta chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Loa Loa (eye worm)	BEN-1 protein	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania infantum	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus multilocularis	Tubulin beta 2C chain	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma japonicum	Tubulin beta chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus granulosus	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Loa Loa (eye worm)	BEN-1 protein	Get druggable targets OG5_126611	All targets in OG5_126611
Trichomonas vaginalis	tubulin epsilon chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania braziliensis	beta-tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus multilocularis	tubulin beta 1 chain	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma japonicum	Tubulin beta-1 chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma japonicum	ko:K07375 tubulin beta, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Giardia lamblia	Beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Leishmania major	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Trypanosoma congolense	beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus multilocularis	Tubulin beta 2C chain	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma mansoni	tubulin subunit beta	Get druggable targets OG5_126611	All targets in OG5_126611
Entamoeba histolytica	tubulin family protein	Get druggable targets OG5_126611	All targets in OG5_126611
Schistosoma mansoni	tubulin subunit beta	Get druggable targets OG5_126611	All targets in OG5_126611
Trichomonas vaginalis	tubulin, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Giardia lamblia	Beta tubulin	Get druggable targets OG5_126611	All targets in OG5_126611
Neospora caninum	hypothetical protein	Get druggable targets OG5_126611	All targets in OG5_126611
Theileria parva	tubulin beta chain, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Toxoplasma gondii	beta-1 tubulin, putative	Get druggable targets OG5_126611	All targets in OG5_126611
Echinococcus multilocularis	tubulin, beta 4A class IVa	Get druggable targets OG5_126611	All targets in OG5_126611

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Plasmodium falciparum	tubulin gamma chain	tubulin, beta 2B class IIb	445 aa	438 aa	32.9 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0116	0.009	0.009
Schistosoma mansoni	tubulin subunit epsilon	0.0116	0.009	0.009
Toxoplasma gondii	fructose-bisphospatase I	0.1624	0.3606	0.3606
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Brugia malayi	Tubulin gamma chain	0.0116	0.009	0.009
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Schistosoma mansoni	tubulin subunit alpha	0.0116	0.009	0.009
Loa Loa (eye worm)	acetylcholinesterase 1	0.0272	0.0455	0.0455
Echinococcus granulosus	tubulin beta 4A class IVa	0.0134	0.0132	0.0132
Plasmodium falciparum	alpha tubulin 2	0.0116	0.009	0.4317
Trypanosoma cruzi	fructose-1,6-bisphosphatase, cytosolic, putative	0.4368	1	1
Trypanosoma cruzi	epsilon tubulin, putative	0.0116	0.009	0.0032
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Echinococcus multilocularis	hypothetical protein	0.0116	0.009	0.009
Loa Loa (eye worm)	tubulin gamma chain	0.0116	0.009	0.009
Echinococcus granulosus	tubulin alpha chain	0.0116	0.009	0.009
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Trichomonas vaginalis	tubulin gamma chain, putative	0.0134	0.0132	1
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Loa Loa (eye worm)	hypothetical protein	0.0116	0.009	0.009
Schistosoma mansoni	alpha tubulin	0.0116	0.009	0.009
Trichomonas vaginalis	tubulin alpha chain, putative	0.0134	0.0132	1
Schistosoma mansoni	alpha tubulin	0.0116	0.009	0.009
Loa Loa (eye worm)	hypothetical protein	0.0272	0.0455	0.0455
Echinococcus granulosus	carboxylesterase 5A	0.0272	0.0455	0.0455
Trypanosoma brucei	beta tubulin	0.0134	0.0132	0.0043
Trypanosoma cruzi	tubulin gamma chain	0.0116	0.009	0.0032
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0116	0.009	0.009
Toxoplasma gondii	alpha tubulin TUBA1	0.0116	0.009	0.009
Echinococcus granulosus	beta tubulin	0.0134	0.0132	0.0132
Echinococcus granulosus	tubulin alpha chain	0.0116	0.009	0.009
Echinococcus granulosus	tissue type plasminogen activator	0.0102	0.0057	0.0057
Toxoplasma gondii	beta-tubulin, putative	0.0134	0.0132	0.0132
Echinococcus granulosus	Tubulin beta 2C chain	0.0134	0.0132	0.0132
Brugia malayi	Carboxylesterase family protein	0.0272	0.0455	0.0455
Loa Loa (eye worm)	alpha-tubulin	0.0116	0.009	0.009
Plasmodium falciparum	tubulin epsilon chain, putative	0.0116	0.009	0.4317
Plasmodium vivax	tubulin gamma chain, putative	0.0116	0.009	0.4317
Echinococcus multilocularis	acetylcholinesterase	0.0272	0.0455	0.0455
Schistosoma mansoni	hypothetical protein	0.0102	0.0057	0.0057
Echinococcus granulosus	beta tubulin	0.0134	0.0132	0.0132
Schistosoma mansoni	tubulin subunit alpha	0.0116	0.009	0.009
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Echinococcus granulosus	tubulin alpha 3 chain	0.0116	0.009	0.009
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0134	0.0132	1
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0116	0.009	0.009
Schistosoma mansoni	tubulin subunit beta	0.0134	0.0132	0.0132
Echinococcus granulosus	peroxisome assembly protein 26	0.0116	0.009	0.009
Loa Loa (eye worm)	hypothetical protein	0.0272	0.0455	0.0455
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Brugia malayi	beta-tubulin, identical	0.0134	0.0132	0.0132
Echinococcus multilocularis	Tubulin beta 2C chain	0.0134	0.0132	0.0132
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Loa Loa (eye worm)	BEN-1 protein	0.0134	0.0132	0.0132
Loa Loa (eye worm)	tubulin beta-4 chain	0.0134	0.0132	0.0132
Trypanosoma cruzi	beta tubulin, putative	0.0134	0.0132	0.0075
Loa Loa (eye worm)	tubulin alpha chain	0.0116	0.009	0.009
Echinococcus granulosus	tubulin epsilon chain	0.0116	0.009	0.009
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0272	0.0455	0.0455
Echinococcus granulosus	tubulin alpha chain	0.0116	0.009	0.009
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Echinococcus granulosus	acetylcholinesterase	0.0272	0.0455	0.0455
Plasmodium vivax	tubulin beta chain, putative	0.0134	0.0132	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0134	0.0132	1
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Echinococcus granulosus	Tubulin beta 2C chain	0.0134	0.0132	0.0132
Loa Loa (eye worm)	carboxylesterase	0.0272	0.0455	0.0455
Trypanosoma cruzi	alpha tubulin, putative	0.0116	0.009	0.0032
Schistosoma mansoni	tubulin subunit beta	0.0134	0.0132	0.0132
Entamoeba histolytica	tubulin family protein	0.0134	0.0132	1
Trypanosoma cruzi	epsilon tubulin, putative	0.0116	0.009	0.0032
Brugia malayi	Tubulin alpha chain	0.0116	0.009	0.009
Schistosoma mansoni	alpha tubulin	0.0116	0.009	0.009
Loa Loa (eye worm)	tubulin beta-2A chain	0.0134	0.0132	0.0132
Echinococcus multilocularis	Tubulin beta 2C chain	0.0134	0.0132	0.0132
Loa Loa (eye worm)	BEN-1 protein	0.0134	0.0132	0.0132
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Loa Loa (eye worm)	tubulin alpha chain	0.0116	0.009	0.009
Echinococcus multilocularis	tubulin alpha chain	0.0116	0.009	0.009
Onchocerca volvulus		0.0102	0.0057	1
Brugia malayi	Tubulin alpha-2 chain	0.0116	0.009	0.009
Echinococcus multilocularis	Tubulin beta 2C chain	0.0134	0.0132	0.0132
Brugia malayi	Kringle domain containing protein	0.0102	0.0057	0.0057
Echinococcus granulosus	Tubulin beta 2C chain	0.0134	0.0132	0.0132
Trypanosoma brucei	beta tubulin	0.0134	0.0132	0.0043
Echinococcus multilocularis	peroxisome assembly protein 26	0.0116	0.009	0.009
Echinococcus multilocularis	tubulin alpha chain	0.0116	0.009	0.009
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Echinococcus multilocularis	tubulin alpha	0.0116	0.009	0.009
Brugia malayi	Tubulin alpha-2 chain	0.0116	0.009	0.009
Schistosoma mansoni	tubulin subunit gamma	0.0116	0.009	0.009
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Echinococcus granulosus	tubulin alpha 1C chain	0.0116	0.009	0.009
Echinococcus multilocularis	tubulin alpha 3 chain	0.0116	0.009	0.009
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Trypanosoma cruzi	sedoheptulose-1,7-bisphosphatase, putative	0.1624	0.3606	0.3569
Toxoplasma gondii	sedoheptulose-1,7-bisphosphatase	0.1624	0.3606	0.3606
Echinococcus multilocularis	tubulin beta 1 chain	0.0134	0.0132	0.0132
Schistosoma mansoni	tubulin subunit beta	0.0134	0.0132	0.0132
Echinococcus multilocularis	tubulin subunit beta	0.0134	0.0132	0.0132
Echinococcus multilocularis	carboxylesterase 5A	0.0272	0.0455	0.0455
Echinococcus granulosus	tubulin alpha chain	0.0116	0.009	0.009
Echinococcus granulosus	Tubulin alpha 1 chain	0.0116	0.009	0.009
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Toxoplasma gondii	alpha-tubulin I, putative	0.0116	0.009	0.009
Echinococcus granulosus	fructose 16 bisphosphatase 1	0.4368	1	1
Echinococcus granulosus	Tubulin alpha 1 chain	0.0116	0.009	0.009
Toxoplasma gondii	beta-1 tubulin, putative	0.0134	0.0132	0.0132
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Schistosoma mansoni	tubulin subunit beta	0.0134	0.0132	0.0132
Loa Loa (eye worm)	beta-tubulin	0.0134	0.0132	0.0132
Giardia lamblia	Beta tubulin	0.0134	0.0132	1
Echinococcus multilocularis	beta tubulin	0.0134	0.0132	0.0132
Echinococcus granulosus	Tubulin alpha 1 chain	0.0116	0.009	0.009
Leishmania major		0.4368	1	1
Echinococcus granulosus	tubulin alpha chain	0.0116	0.009	0.009
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0116	0.009	0.009
Schistosoma mansoni	tubulin subunit beta	0.0134	0.0132	0.0132
Echinococcus multilocularis	tubulin alpha 1C chain	0.0116	0.009	0.009
Schistosoma mansoni	fructose-16-bisphosphatase-related	0.4368	1	1
Plasmodium falciparum	tubulin beta chain	0.0134	0.0132	1
Trypanosoma brucei	fructose-1,6-bisphosphatase	0.4368	1	1
Echinococcus multilocularis	tubulin subunit TubB	0.0116	0.009	0.009
Echinococcus granulosus	alpha tubulin	0.0116	0.009	0.009
Plasmodium falciparum	alpha tubulin 1	0.0116	0.009	0.4317
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Echinococcus multilocularis	tubulin alpha 3 chain	0.0116	0.009	0.009
Toxoplasma gondii	kringle domain-containing protein	0.0102	0.0057	0.0057
Echinococcus granulosus	tubulin gamma 1 chain	0.0116	0.009	0.009
Trypanosoma brucei	sedoheptulose-1,7-bisphosphatase	0.1624	0.3606	0.3548
Plasmodium vivax	tubulin alpha chain, putative	0.0116	0.009	0.4317
Echinococcus multilocularis	tubulin epsilon chain	0.0116	0.009	0.009
Echinococcus granulosus	tubulin alpha 1C chain	0.0116	0.009	0.009
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Echinococcus multilocularis	tubulin alpha 1C chain	0.0116	0.009	0.009
Echinococcus granulosus	tubulin alpha 3 chain	0.0116	0.009	0.009
Leishmania major	gamma-tubulin	0.0116	0.009	0.0032
Loa Loa (eye worm)	hypothetical protein	0.0102	0.0057	0.0057
Echinococcus multilocularis	Tubulin beta 2C chain	0.0134	0.0132	0.0132
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Brugia malayi	tubulin alpha chain - mouse	0.0116	0.009	0.009
Plasmodium vivax	tubulin alpha chain, putative	0.0116	0.009	0.4317
Echinococcus granulosus	tubulin beta 1 chain	0.0134	0.0132	0.0132
Loa Loa (eye worm)	tubulin beta-1 chain	0.0134	0.0132	0.0132
Trypanosoma cruzi	fructose-1,6-bisphosphatase, cytosolic, putative	0.4368	1	1
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Brugia malayi	Tubulin beta-1 chain	0.0134	0.0132	0.0132
Echinococcus multilocularis	tubulin gamma 1 chain	0.0116	0.009	0.009
Echinococcus multilocularis	acetylcholinesterase	0.0272	0.0455	0.0455
Echinococcus granulosus	Tubulin beta 2C chain	0.0134	0.0132	0.0132
Giardia lamblia	Beta tubulin	0.0134	0.0132	1
Loa Loa (eye worm)	tubulin beta chain	0.0134	0.0132	0.0132
Echinococcus multilocularis	tissue type plasminogen activator	0.0102	0.0057	0.0057
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0134	0.0132	0.0132
Echinococcus multilocularis	Tubulin beta 2C chain	0.0134	0.0132	0.0132
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Brugia malayi	alpha-tubulin	0.0116	0.009	0.009
Brugia malayi	Protein kinase domain containing protein	0.0102	0.0057	0.0057
Loa Loa (eye worm)	fructose-1,6-bisphosphatase	0.4368	1	1
Entamoeba histolytica	tubulin family protein	0.0134	0.0132	1
Toxoplasma gondii	beta tubulin	0.0134	0.0132	0.0132
Plasmodium vivax	tubulin epsilon chain, putative	0.0116	0.009	0.4317
Echinococcus granulosus	Tubulin beta 2C chain	0.0134	0.0132	0.0132
Giardia lamblia	Beta tubulin	0.0134	0.0132	1
Leishmania major	epsilon tubulin, putative	0.0116	0.009	0.0032
Loa Loa (eye worm)	alpha-tubulin	0.0116	0.009	0.009
Trichomonas vaginalis	tubulin, putative	0.0134	0.0132	1
Trypanosoma brucei	beta tubulin	0.0134	0.0132	0.0043
Loa Loa (eye worm)	TK/ROR protein kinase	0.0102	0.0057	0.0057
Echinococcus multilocularis	fructose 1,6 bisphosphatase 1	0.4368	1	1
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Leishmania major	beta tubulin	0.0134	0.0132	0.0075
Echinococcus multilocularis	tubulin alpha chain	0.0116	0.009	0.009
Echinococcus granulosus	tubulin alpha	0.0116	0.009	0.009
Echinococcus granulosus	acetylcholinesterase	0.0272	0.0455	0.0455
Echinococcus granulosus	tubulin subunit TubB	0.0116	0.009	0.009
Schistosoma mansoni	tubulin subunit beta	0.0134	0.0132	0.0132
Toxoplasma gondii	fructose-bisphospatase II	0.4368	1	1
Echinococcus multilocularis	beta tubulin	0.0134	0.0132	0.0132
Brugia malayi	Carboxylesterase family protein	0.0272	0.0455	0.0455
Plasmodium falciparum	tubulin gamma chain	0.0116	0.009	0.4317
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0116	0.009	0.009
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Trypanosoma brucei	beta tubulin	0.0134	0.0132	0.0043
Leishmania major	alpha tubulin	0.0116	0.009	0.0032
Brugia malayi	tubulin alpha-2 chain	0.0116	0.009	0.009
Echinococcus multilocularis	tubulin alpha chain	0.0116	0.009	0.009
Trypanosoma cruzi	sedoheptulose-1,7-bisphosphatase, putative	0.1624	0.3606	0.3569
Echinococcus multilocularis	tubulin alpha chain	0.0116	0.009	0.009
Echinococcus granulosus	tubulin subunit beta	0.0134	0.0132	0.0132
Schistosoma mansoni	tubulin subunit alpha	0.0116	0.009	0.009
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0134	0.0132	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 15 nM	Cytotoxicity against human MCF7 cells after 96 hrs by Giemsa staining-based light microscopy	ChEMBL.	25025991
IC50 (binding)	= 1.3 uM	Inhibition of tubulin (unknown origin) polymerization incubated 15 mins prior to GTP addition by spectrophotometry	ChEMBL.	25025991
Inhibition (binding)	= 81 %	Displacement of [3H]colchicine from tubulin (unknown origin) at 5 uM after 10 mins	ChEMBL.	25025991

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	25025991

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

ChEMBL: CHEMBL3318101

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 922003