TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 372.455 | Formula: C22H28O5
H donors: 4 H acceptors: 4 LogP: 2.54 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: OC[C@H]([C@H]1O[C@H]([C@@H]([C@H]1O)O)c1ccc(c(c1)Cc1ccc(cc1)CC)C)O
InChi: 1S/C22H28O5/c1-3-14-5-7-15(8-6-14)10-17-11-16(9-4-13(17)2)21-19(25)20(26)22(27-21)18(24)12-23/h4-9,11,18-26H,3,10,12H2,1-2H3/t18-,19-,20-,21+,22-/m1/s1
InChiKey: MLHQBFISQGOVKQ-CSEOROSGSA-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	solute carrier family 5 (sodium/glucose cotransporter), member 2	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	Sodium/myo-inositol cotransporter, putative	Get druggable targets OG5_127197	All targets in OG5_127197
Echinococcus granulosus	sodium:myo inositol cotransporter	Get druggable targets OG5_127197	All targets in OG5_127197
Schistosoma mansoni	inositol transporter	Get druggable targets OG5_127197	All targets in OG5_127197
Schistosoma japonicum	ko:K03307 solute:Na+ symporter, SSS family, putative	Get druggable targets OG5_127197	All targets in OG5_127197
Echinococcus granulosus	sodium:glucose cotransporter 2	Get druggable targets OG5_127197	All targets in OG5_127197
Schistosoma japonicum	expressed protein	Get druggable targets OG5_127197	All targets in OG5_127197
Echinococcus multilocularis	sodium:myo inositol cotransporter	Get druggable targets OG5_127197	All targets in OG5_127197
Echinococcus granulosus	sodium:glucose cotransporter	Get druggable targets OG5_127197	All targets in OG5_127197
Echinococcus granulosus	solute carrier family 5	Get druggable targets OG5_127197	All targets in OG5_127197
Echinococcus multilocularis	solute carrier family 5	Get druggable targets OG5_127197	All targets in OG5_127197
Echinococcus multilocularis	sodium:glucose cotransporter 2	Get druggable targets OG5_127197	All targets in OG5_127197
Schistosoma mansoni	inositol transporter	Get druggable targets OG5_127197	All targets in OG5_127197

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Entamoeba histolytica	hypothetical protein	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	hypothetical protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	tyrosine- protein kinase 2, putative	0.0111	0	0.5
Entamoeba histolytica	cysteine surface protein, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TK family protein kinase	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Trichomonas vaginalis	protein kinase atn1, putative	0.0111	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0111	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Trichomonas vaginalis	STE family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.6877	0.9838	1
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Entamoeba histolytica	hypothetical protein	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Giardia lamblia	Kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	ankyrin repeat protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trypanosoma brucei	Flagellum attachment zone protein 20	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	receptor protein kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	AGC family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.6877	0.9838	1
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.0111	0	0.5
Plasmodium vivax	tyrosine kinase-like protein, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Trichomonas vaginalis	serine-threonine protein kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Plasmodium falciparum	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.0111	0	0.5
Leishmania major	protein kinase, putative	0.0111	0	0.5
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Entamoeba histolytica	hypothetical protein	0.0111	0	0.5
Entamoeba histolytica	tyrosin kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Entamoeba histolytica	receptor protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Entamoeba histolytica	hypothetical protein	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Echinococcus granulosus	sodium:glucose cotransporter	0.0181	0.0102	0.0103
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Trypanosoma brucei	AGC/RSK family serine/threonine kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Entamoeba histolytica	hypothetical protein	0.0111	0	0.5
Entamoeba histolytica	hypothetical protein	0.0111	0	0.5
Giardia lamblia	Kinase, NEK	0.0111	0	0.5
Trichomonas vaginalis	CAMK family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Plasmodium falciparum	protein kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Brugia malayi	Protein kinase domain containing protein	0.6877	0.9838	1
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	0.6877	0.9838	1
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Toxoplasma gondii	STE kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Schistosoma mansoni	inositol transporter	0.0181	0.0102	0.0102
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	hypothetical protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Trypanosoma brucei	protein kinase, putative	0.0111	0	0.5
Loa Loa (eye worm)	TKL/MLK/LZK protein kinase	0.6877	0.9838	1
Echinococcus multilocularis	sodium:glucose cotransporter 2	0.0181	0.0102	0.0103
Trypanosoma brucei	STE/STE11 serine/threonine-protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Echinococcus granulosus	mitogen activated protein kinase kinase kinase	0.6877	0.9838	1
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase with ankyrin repeats, putative	0.0111	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Echinococcus granulosus	sodium:glucose cotransporter 2	0.0181	0.0102	0.0103
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Echinococcus granulosus	solute carrier family 5	0.0181	0.0102	0.0103
Onchocerca volvulus		0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Onchocerca volvulus	Tyrosine kinase homolog	0.0111	0	0.5
Entamoeba histolytica	hypothetical protein	0.0111	0	0.5
Onchocerca volvulus	Atrial natriuretic peptide receptor 3 homolog	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Plasmodium falciparum	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Toxoplasma gondii	protein kinase domain-containing protein	0.0111	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	br serine/threonine-protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	tyrosin kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Plasmodium vivax	tyrosine kinase-like protein, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Trichomonas vaginalis	serine/threonine-protein kinase wnk, putative	0.0111	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Trichomonas vaginalis	protein tyrosine kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Leishmania major	hypothetical protein, conserved	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Toxoplasma gondii	calcium dependent protein kinase CDPK8	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	ankyrin repeat protein	0.0111	0	0.5
Echinococcus multilocularis	solute carrier family 5	0.0181	0.0102	0.0103
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Plasmodium falciparum	tyrosine kinase-like protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Echinococcus multilocularis	sodium:myo inositol cotransporter	0.0181	0.0102	0.0103
Trypanosoma brucei	Pseudokinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	hypothetical protein, conserved	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Giardia lamblia	Protein 21.1	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Entamoeba histolytica	leucine-rich repeat domain-containing protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Onchocerca volvulus	Tyrosine kinase receptor Cad96Ca homolog	0.0111	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0111	0	0.5
Schistosoma mansoni	inositol transporter	0.0181	0.0102	0.0102
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	tyrosin kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	hypothetical protein	0.0111	0	0.5
Plasmodium vivax	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	hypothetical protein	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Leishmania major	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0111	0	0.5
Entamoeba histolytica	tyrosin kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0111	0	0.5
Toxoplasma gondii	protein kinase	0.0111	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Onchocerca volvulus		0.0111	0	0.5
Trypanosoma cruzi	protein kinase, putative	0.0111	0	0.5
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Echinococcus granulosus	sodium:myo inositol cotransporter	0.0181	0.0102	0.0103
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Giardia lamblia	Kinase, NEK	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0111	0	0.5
Plasmodium falciparum	tyrosine kinase-like protein	0.0111	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0111	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0111	0	0.5
Trypanosoma cruzi	protein kinase, putative	0.0111	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0111	0	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (binding)	= 2.5 uM	Inhibition of human SGLT2 expressed in CHO-K1 cells assessed as inhibition of [14C]-AMG uptake up to 120 mins by scintillation counting method	ChEMBL.	24071445
EC50 (binding)	> 50 uM	Inhibition of human SGLT1 expressed in CHO-K1 cells assessed as inhibition of [14C]-AMG uptake up to 120 mins by scintillation counting method	ChEMBL.	24071445

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: CHEMBL2440367

Bibliographic References

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Detailed information for compound 1791945