TDR Targets

Basic information

Technical information

TDR Targets ID: 1791181
Name: 7-dimethylamino-2-oxochromene-3-carboxylic ac id
MW: 233.22 | Formula: C12H11NO4
H donors: 1 H acceptors: 3 LogP: 2.32 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: CN(c1ccc2c(c1)oc(=O)c(c2)C(=O)O)C
InChi: 1S/C12H11NO4/c1-13(2)8-4-3-7-5-9(11(14)15)12(16)17-10(7)6-8/h3-6H,1-2H3,(H,14,15)
InChiKey: UDMURVSWYOLZAU-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

7-dimethylamino-2-oxo-chromene-3-carboxylic acid
7-dimethylamino-2-oxo-3-chromenecarboxylic acid
7-dimethylamino-2-keto-chromene-3-carboxylic acid

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	solute carrier family 16 (monocarboxylate transporter), member 3	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	Major Facilitator Superfamily protein	solute carrier family 16 (monocarboxylate transporter), member 3	465 aa	438 aa	24.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Toxoplasma gondii	STE kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	ankyrin repeat protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	receptor protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein, conserved	0.0033	0	0.5
Entamoeba histolytica	tyrosin kinase, putative	0.0033	0	0.5
Entamoeba histolytica	tyrosin kinase, putative	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Entamoeba histolytica	tyrosin kinase, putative	0.0033	0	0.5
Toxoplasma gondii	protein kinase	0.0033	0	0.5
Trichomonas vaginalis	protein kinase atn1, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Giardia lamblia	Protein 21.1	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Plasmodium falciparum	tyrosine kinase-like protein	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Leishmania major	protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein	0.0033	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0	0.5
Plasmodium falciparum	protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Giardia lamblia	Kinase, NEK	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Entamoeba histolytica	tyrosin kinase, putative	0.0033	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Entamoeba histolytica	leucine-rich repeat domain-containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	receptor protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TK family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	serine/threonine-protein kinase wnk, putative	0.0033	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Plasmodium falciparum	protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	tyrosine- protein kinase 2, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Plasmodium vivax	protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	protein tyrosine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Toxoplasma gondii	protein kinase domain-containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	CAMK family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	cysteine surface protein, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase with ankyrin repeats, putative	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trypanosoma brucei	Flagellum attachment zone protein 20	0.0033	0	0.5
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.0033	0	0.5
Giardia lamblia	Kinase	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein	0.0033	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	serine-threonine protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Toxoplasma gondii	calcium dependent protein kinase CDPK8	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Trypanosoma brucei	STE/STE11 serine/threonine-protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	ankyrin repeat protein	0.0033	0	0.5
Onchocerca volvulus	Atrial natriuretic peptide receptor 3 homolog	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Echinococcus granulosus	mitogen activated protein kinase kinase kinase	0.2029	0.9838	1
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Leishmania major	hypothetical protein, conserved	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Brugia malayi	Protein kinase domain containing protein	0.2029	0.9838	1
Trypanosoma brucei	protein kinase, putative	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Giardia lamblia	Kinase, NEK	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein	0.0033	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein	0.0033	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trypanosoma cruzi	protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0	0.5
Trypanosoma brucei	AGC/RSK family serine/threonine kinase, putative	0.0033	0	0.5
Onchocerca volvulus	Tyrosine kinase receptor Cad96Ca homolog	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	hypothetical protein	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Plasmodium vivax	tyrosine kinase-like protein, putative	0.0033	0	0.5
Trichomonas vaginalis	AGC family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Plasmodium falciparum	protein kinase, putative	0.0033	0	0.5
Plasmodium falciparum	tyrosine kinase-like protein	0.0033	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Trichomonas vaginalis	STE family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0033	0	0.5
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	0.2029	0.9838	1
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Trypanosoma cruzi	protein kinase, putative	0.0033	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.2029	0.9838	1
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.0033	0	0.5
Leishmania major	protein kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trypanosoma brucei	Pseudokinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Onchocerca volvulus		0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Plasmodium vivax	tyrosine kinase-like protein, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Onchocerca volvulus	Tyrosine kinase homolog	0.0033	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.2029	0.9838	1
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0033	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.0033	0	0.5
Loa Loa (eye worm)	TKL/MLK/LZK protein kinase	0.2029	0.9838	1
Onchocerca volvulus		0.0033	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5
Trichomonas vaginalis	br serine/threonine-protein kinase, putative	0.0033	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0033	0	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	= 2.9 uM	Cytotoxicity against human SiHa cells in lactate-containing medium after 72 hrs by MTT assay	ChEMBL.	24095010
IC50 (binding)	= 1.4 uM	Inhibition of MCT4-mediated [14C]-lactate uptake in human SiHa cells in lactate-containing medium assessed as remaining lactate concentration in culture medium after 24 hrs by liquid scintillation counting	ChEMBL.	24095010

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	24095010

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: CHEMBL2442510

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1791181