TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 417.522 | Formula: C21H27N3O4S
H donors: 1 H acceptors: 5 LogP: 2.9 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: O=C([C@@H](n1ccc(cc1=O)S(=O)(=O)C(C)C)CC1CCCC1)Nc1ccccn1
InChi: 1S/C21H27N3O4S/c1-15(2)29(27,28)17-10-12-24(20(25)14-17)18(13-16-7-3-4-8-16)21(26)23-19-9-5-6-11-22-19/h5-6,9-12,14-16,18H,3-4,7-8,13H2,1-2H3,(H,22,23,26)/t18-/m0/s1
InChiKey: KJRHORYIQZIXHO-SFHVURJKSA-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	glucokinase (hexokinase 4)	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Plasmodium berghei	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Echinococcus multilocularis	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Onchocerca volvulus		Get druggable targets OG5_126743	All targets in OG5_126743
Theileria parva	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126743	All targets in OG5_126743
Echinococcus granulosus	hexokinase type 2	Get druggable targets OG5_126743	All targets in OG5_126743
Cryptosporidium hominis	hexokinase i	Get druggable targets OG5_126743	All targets in OG5_126743
Trypanosoma brucei gambiense	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Onchocerca volvulus		Get druggable targets OG5_126743	All targets in OG5_126743
Babesia bovis	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Trypanosoma congolense	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Neospora caninum	cDNA FLJ57348, highly similar to Homo sapiens hexokinase domain containing 1 (HKDC1), mRNA, related	Get druggable targets OG5_126743	All targets in OG5_126743
Brugia malayi	Hexokinase family protein	Get druggable targets OG5_126743	All targets in OG5_126743
Candida albicans	similar to D.occidentalis hexokinase HXK which is able to phosphorylate glucose and fructose	Get druggable targets OG5_126743	All targets in OG5_126743
Echinococcus multilocularis	hexokinase type 2	Get druggable targets OG5_126743	All targets in OG5_126743
Trypanosoma brucei	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Leishmania mexicana	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Onchocerca volvulus		Get druggable targets OG5_126743	All targets in OG5_126743
Echinococcus granulosus	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Loa Loa (eye worm)	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Candida albicans	one of four closely related hexokinase-like genes similar to P.angusta GLK1 and to S. cerevisiae Glucokinase GLK1 (YCL040W)	Get druggable targets OG5_126743	All targets in OG5_126743
Candida albicans	one of four closely related hexokinase-like genes similar to P.angusta GLK1 and to S. cerevisiae Glucokinase GLK1 (YCL040W)	Get druggable targets OG5_126743	All targets in OG5_126743
Loa Loa (eye worm)	hexokinase type II	Get druggable targets OG5_126743	All targets in OG5_126743
Plasmodium falciparum	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Entamoeba histolytica	hexokinase 2	Get druggable targets OG5_126743	All targets in OG5_126743
Echinococcus multilocularis	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Leishmania donovani	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Trypanosoma brucei	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Trypanosoma cruzi	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Schistosoma japonicum	ko:K00844 hexokinase [EC2.7.1.1], putative	Get druggable targets OG5_126743	All targets in OG5_126743
Leishmania major	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Leishmania major	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Schistosoma mansoni	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Candida albicans	one of four closely related hexokinase-like genes similar to P.angusta GLK1 and to S. cerevisiae Glucokinase GLK1 (YCL040W)	Get druggable targets OG5_126743	All targets in OG5_126743
Toxoplasma gondii	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Echinococcus granulosus	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Echinococcus granulosus	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Leishmania mexicana	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Leishmania braziliensis	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Plasmodium vivax	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Trypanosoma brucei gambiense	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Entamoeba histolytica	hexokinase 1	Get druggable targets OG5_126743	All targets in OG5_126743
Plasmodium knowlesi	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Leishmania infantum	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Candida albicans	similar to D.occidentalis hexokinase HXK which is able to phosphorylate glucose and fructose	Get druggable targets OG5_126743	All targets in OG5_126743
Leishmania infantum	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Echinococcus multilocularis	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Candida albicans	one of four closely related hexokinase-like genes similar to P.angusta GLK1 and to S. cerevisiae Glucokinase GLK1 (YCL040W)	Get druggable targets OG5_126743	All targets in OG5_126743
Cryptosporidium parvum	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Trypanosoma cruzi	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Brugia malayi	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Loa Loa (eye worm)	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Treponema pallidum	hexokinase (hxk)	Get druggable targets OG5_126743	All targets in OG5_126743
Trypanosoma brucei	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743
Theileria parva	hexokinase, putative	Get druggable targets OG5_126743	All targets in OG5_126743
Candida albicans	one of four closely related hexokinase-like genes similar to P.angusta GLK1 and to S. cerevisiae GLK1 (YCL040W)	Get druggable targets OG5_126743	All targets in OG5_126743
Candida albicans	one of four closely related hexokinase-like genes similar to P.angusta GLK1 and to S. cerevisiae Glucokinase GLK1 (YCL040W)	Get druggable targets OG5_126743	All targets in OG5_126743
Candida albicans	one of four closely related hexokinase-like genes similar to P.angusta GLK1 and to S. cerevisiae Glucokinase GLK1 (YCL040W)	Get druggable targets OG5_126743	All targets in OG5_126743
Plasmodium yoelii	hexokinase	Get druggable targets OG5_126743	All targets in OG5_126743

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	Hexokinase family protein	glucokinase (hexokinase 4)	465 aa	470 aa	30.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Echinococcus granulosus	tubulin alpha 1C chain	0.018	0.6633	0.5904
Trypanosoma brucei	alpha tubulin	0.018	0.6633	0.6486
Schistosoma mansoni	alpha tubulin	0.018	0.6633	0.5904
Echinococcus granulosus	tubulin beta 1 chain	0.0237	1	1
Loa Loa (eye worm)	tubulin beta-1 chain	0.0237	1	1
Echinococcus granulosus	tubulin alpha 1C chain	0.018	0.6633	0.5904
Echinococcus granulosus	Tubulin alpha 1 chain	0.018	0.6633	0.5904
Trypanosoma brucei	beta tubulin	0.0237	1	1
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Echinococcus multilocularis	tubulin alpha 1C chain	0.018	0.6633	0.5904
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Brugia malayi	Hexokinase family protein	0.0096	0.178	0.1421
Giardia lamblia	Beta tubulin	0.0237	1	1
Toxoplasma gondii	beta-1 tubulin, putative	0.0237	1	1
Trypanosoma cruzi	beta tubulin, putative	0.0237	1	1
Schistosoma mansoni	tubulin subunit beta	0.0237	1	1
Trichomonas vaginalis	tubulin alpha chain, putative	0.0237	1	1
Echinococcus multilocularis	tubulin alpha	0.0129	0.3668	0.2298
Echinococcus granulosus	Tubulin beta 2C chain	0.0237	1	1
Onchocerca volvulus		0.0096	0.178	1
Echinococcus multilocularis	tubulin alpha chain	0.018	0.6633	0.5904
Leishmania major	beta tubulin	0.0237	1	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0237	1	1
Trypanosoma cruzi	epsilon tubulin, putative	0.0129	0.3668	0.2298
Echinococcus multilocularis	tubulin alpha chain	0.018	0.6633	0.5904
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0237	1	1
Echinococcus multilocularis	tubulin alpha 3 chain	0.018	0.6633	0.5904
Trypanosoma brucei	epsilon tubulin	0.0129	0.3668	0.3392
Brugia malayi	Tubulin gamma chain	0.0129	0.3668	0.3392
Plasmodium falciparum	alpha tubulin 2	0.018	0.6633	0.5904
Giardia lamblia	Alpha-tubulin	0.018	0.6633	0.4682
Leishmania major	beta tubulin	0.0237	1	1
Trichomonas vaginalis	tubulin, putative	0.0237	1	1
Trypanosoma brucei	epsilon tubulin	0.0129	0.3668	0.3392
Plasmodium vivax	tubulin gamma chain, putative	0.0129	0.3668	0.2298
Echinococcus granulosus	tubulin gamma 1 chain	0.0129	0.3668	0.2298
Plasmodium falciparum	tubulin gamma chain	0.0129	0.3668	0.2298
Schistosoma mansoni	tubulin subunit beta	0.0237	1	1
Loa Loa (eye worm)	tubulin alpha 2	0.0124	0.3383	0.3383
Leishmania major	beta tubulin	0.0237	1	1
Trypanosoma brucei	hexokinase	0.0096	0.178	0.1421
Trypanosoma brucei	beta tubulin	0.0237	1	1
Toxoplasma gondii	beta tubulin	0.0237	1	1
Leishmania major	beta tubulin	0.0237	1	1
Trichomonas vaginalis	tubulin beta chain, putative	0.018	0.6633	0.6486
Echinococcus granulosus	tubulin alpha chain	0.018	0.6633	0.5904
Loa Loa (eye worm)	tubulin alpha-3 chain	0.0107	0.2397	0.2397
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0124	0.3383	0.3094
Leishmania major	beta tubulin	0.0237	1	1
Toxoplasma gondii	alpha-tubulin I, putative	0.018	0.6633	0.5904
Echinococcus granulosus	Tubulin beta 2C chain	0.0237	1	1
Echinococcus multilocularis	beta tubulin	0.0237	1	1
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Echinococcus multilocularis	tubulin epsilon chain	0.0129	0.3668	0.2298
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0107	0.2397	0.2066
Echinococcus granulosus	Tubulin alpha 1 chain	0.018	0.6633	0.5904
Onchocerca volvulus		0.0096	0.178	1
Echinococcus granulosus	tubulin beta 4A class IVa	0.0237	1	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0237	1	1
Echinococcus multilocularis	tubulin gamma 1 chain	0.0129	0.3668	0.2298
Echinococcus granulosus	Tubulin beta 2C chain	0.0237	1	1
Loa Loa (eye worm)	alpha-tubulin isotype 2	0.0124	0.3383	0.3383
Brugia malayi	Tubulin alpha chain	0.018	0.6633	0.6486
Plasmodium falciparum	tubulin epsilon chain, putative	0.0129	0.3668	0.2298
Loa Loa (eye worm)	hypothetical protein	0.0124	0.3383	0.3383
Plasmodium vivax	tubulin epsilon chain, putative	0.0129	0.3668	0.2298
Entamoeba histolytica	tubulin alpha-1 chain	0.018	0.6633	0.5904
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Trichomonas vaginalis	tubulin beta chain, putative	0.018	0.6633	0.6486
Loa Loa (eye worm)	hypothetical protein	0.0107	0.2397	0.2397
Trichomonas vaginalis	tubulin gamma chain, putative	0.0237	1	1
Brugia malayi	tubulin alpha chain - mouse	0.018	0.6633	0.6486
Echinococcus granulosus	tubulin alpha 3 chain	0.018	0.6633	0.5904
Echinococcus multilocularis	Tubulin beta 2C chain	0.0237	1	1
Schistosoma mansoni	tubulin subunit beta	0.0237	1	1
Entamoeba histolytica	tubulin gamma chain	0.0129	0.3668	0.2298
Plasmodium falciparum	alpha tubulin 1	0.018	0.6633	0.5904
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Schistosoma mansoni	tubulin subunit beta	0.0237	1	1
Echinococcus multilocularis	tubulin subunit beta	0.0237	1	1
Trypanosoma brucei	alpha tubulin	0.018	0.6633	0.6486
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Trichomonas vaginalis	tubulin beta chain, putative	0.0237	1	1
Treponema pallidum	hexokinase (hxk)	0.0096	0.178	0.5
Echinococcus multilocularis	Tubulin alpha 1 chain	0.018	0.6633	0.5904
Echinococcus granulosus	tubulin subunit TubB	0.018	0.6633	0.5904
Brugia malayi	alpha-tubulin	0.018	0.6633	0.6486
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Loa Loa (eye worm)	tubulin beta-2A chain	0.0237	1	1
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Trichomonas vaginalis	tubulin gamma chain, putative	0.0129	0.3668	0.3392
Plasmodium vivax	tubulin beta chain, putative	0.0237	1	1
Leishmania major	gamma-tubulin	0.0129	0.3668	0.2298
Trypanosoma cruzi	alpha tubulin, putative	0.018	0.6633	0.5904
Echinococcus granulosus	beta tubulin	0.0237	1	1
Schistosoma mansoni	tubulin subunit epsilon	0.0129	0.3668	0.2298
Echinococcus multilocularis	Tubulin alpha 1 chain	0.018	0.6633	0.5904
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0129	0.3668	0.2298
Leishmania major	beta tubulin	0.0237	1	1
Trichomonas vaginalis	tubulin epsilon chain, putative	0.018	0.6633	0.6486
Leishmania major	beta tubulin	0.0237	1	1
Leishmania major	beta tubulin	0.0237	1	1
Echinococcus multilocularis	tubulin beta 1 chain	0.0237	1	1
Schistosoma mansoni	alpha tubulin	0.018	0.6633	0.5904
Schistosoma mansoni	tubulin subunit alpha	0.018	0.6633	0.5904
Schistosoma mansoni	tubulin subunit alpha	0.018	0.6633	0.5904
Brugia malayi	tubulin alpha-2 chain	0.018	0.6633	0.6486
Trypanosoma cruzi	epsilon tubulin, putative	0.0129	0.3668	0.2298
Brugia malayi	Tubulin alpha-2 chain	0.018	0.6633	0.6486
Loa Loa (eye worm)	hexokinase	0.0096	0.178	0.178
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Leishmania major	beta tubulin	0.0237	1	1
Echinococcus multilocularis	tubulin alpha chain	0.018	0.6633	0.5904
Leishmania major	beta tubulin	0.0237	1	1
Echinococcus granulosus	beta tubulin	0.0237	1	1
Echinococcus granulosus	tubulin subunit beta	0.0237	1	1
Trypanosoma brucei	epsilon tubulin	0.0129	0.3668	0.3392
Echinococcus granulosus	tubulin alpha chain	0.018	0.6633	0.5904
Toxoplasma gondii	beta-tubulin, putative	0.0237	1	1
Trichomonas vaginalis	tubulin gamma chain, putative	0.0129	0.3668	0.3392
Loa Loa (eye worm)	BEN-1 protein	0.0237	1	1
Schistosoma mansoni	tubulin subunit beta	0.0237	1	1
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0237	1	1
Plasmodium vivax	tubulin alpha chain, putative	0.018	0.6633	0.5904
Loa Loa (eye worm)	hexokinase type II	0.0096	0.178	0.178
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0237	1	1
Echinococcus multilocularis	hypothetical protein	0.018	0.6633	0.5904
Leishmania major	alpha tubulin	0.018	0.6633	0.5904
Loa Loa (eye worm)	tubulin beta chain	0.0237	1	1
Trypanosoma brucei	alpha tubulin	0.018	0.6633	0.6486
Loa Loa (eye worm)	tubulin alpha-2 chain	0.018	0.6633	0.6633
Echinococcus granulosus	tubulin epsilon chain	0.0129	0.3668	0.2298
Brugia malayi	hexokinase	0.0096	0.178	0.1421
Trichomonas vaginalis	tubulin beta chain, putative	0.018	0.6633	0.6486
Leishmania major	beta tubulin	0.0237	1	1
Brugia malayi	Tubulin alpha-2 chain	0.018	0.6633	0.6486
Onchocerca volvulus		0.0096	0.178	1
Giardia lamblia	Beta tubulin	0.0237	1	1
Loa Loa (eye worm)	tubulin beta-4 chain	0.0237	1	1
Entamoeba histolytica	tubulin family protein	0.0237	1	1
Echinococcus multilocularis	beta tubulin	0.0237	1	1
Leishmania major	beta tubulin	0.0237	1	1
Echinococcus multilocularis	tubulin subunit TubB	0.018	0.6633	0.5904
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.018	0.6633	0.6486
Loa Loa (eye worm)	BEN-1 protein	0.0237	1	1
Schistosoma mansoni	tubulin subunit gamma	0.0129	0.3668	0.2298
Schistosoma mansoni	alpha tubulin	0.018	0.6633	0.5904
Echinococcus granulosus	tubulin alpha chain	0.018	0.6633	0.5904
Leishmania major	beta tubulin	0.0237	1	1
Loa Loa (eye worm)	tubulin gamma chain	0.0129	0.3668	0.3668
Trypanosoma brucei	beta tubulin	0.0129	0.3668	0.3392
Trypanosoma brucei	hexokinase, putative	0.0096	0.178	0.1421
Echinococcus granulosus	alpha tubulin	0.018	0.6633	0.5904
Echinococcus multilocularis	Tubulin beta 2C chain	0.0237	1	1
Leishmania major	beta tubulin	0.0237	1	1
Schistosoma mansoni	tubulin subunit alpha	0.018	0.6633	0.5904
Trichomonas vaginalis	tubulin beta chain, putative	0.018	0.6633	0.6486
Trypanosoma cruzi	tubulin gamma chain	0.0129	0.3668	0.2298
Plasmodium falciparum	tubulin beta chain	0.0237	1	1
Echinococcus multilocularis	tubulin alpha chain	0.018	0.6633	0.5904
Echinococcus granulosus	tubulin alpha	0.0129	0.3668	0.2298
Loa Loa (eye worm)	alpha-tubulin	0.018	0.6633	0.6633
Loa Loa (eye worm)	hypothetical protein	0.018	0.6633	0.6633
Echinococcus granulosus	tubulin alpha 3 chain	0.018	0.6633	0.5904
Echinococcus multilocularis	tubulin alpha chain	0.018	0.6633	0.5904
Trichomonas vaginalis	tubulin beta chain, putative	0.018	0.6633	0.6486
Trypanosoma brucei	tubulin gamma chain	0.0129	0.3668	0.3392
Trypanosoma brucei	alpha tubulin	0.018	0.6633	0.6486
Trypanosoma brucei	beta tubulin	0.0237	1	1
Leishmania major	epsilon tubulin, putative	0.0129	0.3668	0.2298
Loa Loa (eye worm)	hexokinase	0.0096	0.178	0.178
Leishmania major	beta tubulin	0.0237	1	1
Echinococcus granulosus	peroxisome assembly protein 26	0.018	0.6633	0.5904
Loa Loa (eye worm)	tubulin alpha chain	0.018	0.6633	0.6633
Echinococcus multilocularis	peroxisome assembly protein 26	0.018	0.6633	0.5904
Echinococcus granulosus	Tubulin beta 2C chain	0.0237	1	1
Loa Loa (eye worm)	tubulin alpha chain	0.018	0.6633	0.6633
Loa Loa (eye worm)	alpha-tubulin	0.018	0.6633	0.6633
Echinococcus granulosus	tubulin alpha chain	0.018	0.6633	0.5904
Schistosoma mansoni	tubulin subunit beta	0.0237	1	1
Echinococcus multilocularis	Tubulin alpha 1 chain	0.018	0.6633	0.5904
Trichomonas vaginalis	tubulin epsilon chain, putative	0.018	0.6633	0.6486
Brugia malayi	beta-tubulin, identical	0.0237	1	1
Leishmania major	beta tubulin	0.0237	1	1
Giardia lamblia	Beta tubulin	0.0237	1	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0237	1	1
Leishmania major	beta tubulin	0.0237	1	1
Trichomonas vaginalis	tubulin beta chain, putative	0.018	0.6633	0.6486
Trypanosoma brucei	beta tubulin	0.0237	1	1
Loa Loa (eye worm)	beta-tubulin	0.0237	1	1
Entamoeba histolytica	tubulin alpha chain, putative	0.018	0.6633	0.5904
Echinococcus granulosus	tubulin alpha chain	0.018	0.6633	0.5904
Echinococcus multilocularis	tubulin alpha 3 chain	0.018	0.6633	0.5904
Echinococcus granulosus	Tubulin alpha 1 chain	0.018	0.6633	0.5904
Loa Loa (eye worm)	tubulin alpha 2	0.0124	0.3383	0.3383
Trichomonas vaginalis	tubulin alpha chain, putative	0.0129	0.3668	0.3392
Leishmania major	beta tubulin	0.0237	1	1
Trypanosoma brucei	hexokinase	0.0096	0.178	0.1421
Toxoplasma gondii	alpha tubulin TUBA1	0.018	0.6633	0.5904
Echinococcus multilocularis	tubulin alpha 1C chain	0.018	0.6633	0.5904
Plasmodium vivax	tubulin alpha chain, putative	0.018	0.6633	0.5904
Echinococcus granulosus	Tubulin beta 2C chain	0.0237	1	1
Giardia lamblia	Alpha-tubulin	0.018	0.6633	0.4682
Entamoeba histolytica	tubulin family protein	0.0237	1	1

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (binding)	= 0.6 uM	Activation of human recombinant glucokinase using 6.5 mM glucose by spectrophotometry	ChEMBL.	19435665
Emax (binding)	= 43 %	Activation of human recombinant glucokinase using 6.5 mM glucose by spectrophotometry relative to control	ChEMBL.	19435665

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

ChEMBL: CHEMBL1783751

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1522931