TDR Targets

Basic information

Technical information

TDR Targets ID: 1482071
Name: N-(3-fluoro-4-methylphenyl)-3,6-dimethyl-4-ox ofuro[5,4-d]pyrimidine-5-carboxamide
MW: 315.299 | Formula: C16H14FN3O3
H donors: 1 H acceptors: 2 LogP: 1.99 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: O=C(c1c(C)oc2c1c(=O)n(cn2)C)Nc1ccc(c(c1)F)C
InChi: 1S/C16H14FN3O3/c1-8-4-5-10(6-11(8)17)19-14(21)12-9(2)23-15-13(12)16(22)20(3)7-18-15/h4-7H,1-3H3,(H,19,21)
InChiKey: INVZZIULMGZGEX-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

N-(3-fluoro-4-methyl-phenyl)-3,6-dimethyl-4-oxo-furo[5,4-d]pyrimidine-5-carboxamide
N-(3-fluoro-4-methylphenyl)-3,6-dimethyl-4-oxo-5-furo[5,4-d]pyrimidinecarboxamide
N-(3-fluoro-4-methyl-phenyl)-4-keto-3,6-dimethyl-furo[5,4-d]pyrimidine-5-carboxamide
E947-0012
NCGC00141554-01

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	TAR DNA binding protein	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	TAR DNA-binding protein 43, putative	Get druggable targets OG5_132461	All targets in OG5_132461
Loa Loa (eye worm)	RNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Echinococcus granulosus	tar DNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Brugia malayi	RNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Brugia malayi	TAR-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Loa Loa (eye worm)	TAR-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Brugia malayi	RNA recognition motif domain containing protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma japonicum	TAR DNA-binding protein 43, putative	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Echinococcus multilocularis	tar DNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461

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
Echinococcus granulosus	neutral amino acid transporter A	0.0127	0.3971	1
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.0053	0.1177	0.1327
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0056	0.1319	0.1496
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.014	0.4475	0.608
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0029	0.0303	0.0064
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0191	0.6374	0.8837
Schistosoma mansoni	sodium/dicarboxylate symporter-related	0.0056	0.1314	0.1144
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.0056	0.1319	0.115
Echinococcus granulosus	histone lysine methyltransferase setb	0.0029	0.0303	0.0109
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.2074	0.1992
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.089	0.1291
Echinococcus multilocularis	neutral amino acid transporter A	0.0127	0.3971	1
Echinococcus granulosus	neutral amino acid transporter	0.0127	0.3971	1
Loa Loa (eye worm)	TAR-binding protein	0.0076	0.2074	0.2689
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0056	0.1319	0.246
Echinococcus multilocularis	sodium:dicarboxylate symporter	0.0056	0.1314	0.2784
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0212	0.7175	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0287	1	1
Mycobacterium tuberculosis	Probable C4-dicarboxylate-transport transmembrane protein DctA	0.0127	0.3971	0.5347
Echinococcus multilocularis	tar DNA binding protein	0.0076	0.2074	0.4847
Echinococcus multilocularis	neutral amino acid transporter A	0.0127	0.3971	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.0212	0.7175	1
Echinococcus granulosus	excitatory amino acid transporter 2	0.0127	0.3971	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0049	0.1042	0.1512
Leishmania major	trypanothione reductase	0.0084	0.2345	1
Chlamydia trachomatis	glutamate symporter	0.0127	0.3971	1
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0029	0.0303	0.0036
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.2074	0.1992
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0287	1	1
Loa Loa (eye worm)	RNA binding protein	0.0076	0.2074	0.2689
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.2074	0.1992
Brugia malayi	Pre-SET motif family protein	0.0205	0.689	1
Echinococcus granulosus	Excitatory amino acid transporter	0.0127	0.3971	1
Toxoplasma gondii	thioredoxin reductase	0.0084	0.2345	1
Onchocerca volvulus	Excitatory amino acid transporter homolog	0.0127	0.3971	0.4795
Echinococcus multilocularis	excitatory amino acid transporter 2	0.0127	0.3971	1
Echinococcus multilocularis	excitatory amino acid transporter 2	0.0127	0.3971	1
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0191	0.6374	0.7034
Echinococcus granulosus	excitatory amino acid transporter 2	0.0127	0.3971	1
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0056	0.1319	0.246
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.089	0.1631
Echinococcus granulosus	thioredoxin glutathione reductase	0.0084	0.2363	0.5666
Schistosoma mansoni	sodium/dicarboxylate symporter-related	0.0056	0.1314	0.1144
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0049	0.1042	0.1512
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.014	0.4475	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0287	1	1
Brugia malayi	Excitatory amino acid transporter	0.0127	0.3971	0.5763
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0029	0.0303	0.0036
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.089	0.0891
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.089	0.067
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.089	0.1631
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0076	0.2074	0.2689
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0303	0.0015
Treponema pallidum	glutamate/aspartate transporter	0.0056	0.1314	0.1056
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0056	0.1319	0.2851
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0191	0.6374	0.8837
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0029	0.0289	0.0074
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0029	0.0303	0.0015
Brugia malayi	Thioredoxin reductase	0.0084	0.2345	0.3403
Brugia malayi	latrophilin 2 splice variant baaae	0.0034	0.0459	0.0666
Treponema pallidum	glutamate transporter	0.0056	0.1314	0.1056
Trichomonas vaginalis	set domain proteins, putative	0.0233	0.7953	0.7892
Echinococcus multilocularis	neutral amino acid transporter A	0.0127	0.3971	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0287	1	1
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0459	0.0237
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0287	1	1
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.2074	0.1992
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0056	0.1319	0.2798
Echinococcus multilocularis	neutral amino acid transporter excitatory amino acid transporter	0.0056	0.1314	0.2784
Echinococcus granulosus	excitatory amino acid transporter 3	0.0127	0.3971	1
Loa Loa (eye worm)	thioredoxin reductase	0.0084	0.2345	0.31
Onchocerca volvulus		0.0233	0.7953	1
Brugia malayi	TAR-binding protein	0.0076	0.2074	0.301
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.089	0.067
Mycobacterium tuberculosis	Probable dehydrogenase	0.0191	0.6374	0.8837
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0287	1	1
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0212	0.7175	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0287	1	1
Loa Loa (eye worm)	glutathione reductase	0.0084	0.2345	0.31
Echinococcus granulosus	neutral amino acid transporter A	0.0127	0.3971	1
Brugia malayi	Pre-SET motif family protein	0.0029	0.0303	0.0439
Echinococcus multilocularis	Excitatory amino acid transporter	0.0127	0.3971	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0303	0.0015
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0049	0.1042	0.1122
Echinococcus multilocularis	neutral amino acid transporter excitatory amino acid transporter	0.0127	0.3971	1
Echinococcus granulosus	sodium:dicarboxylate symporter	0.0127	0.3971	1
Plasmodium vivax	SET domain protein, putative	0.0029	0.0303	0.0064
Echinococcus multilocularis	sodium:dicarboxylate symporter	0.0127	0.3971	1
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0191	0.6374	0.8837
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0084	0.2345	0.2985
Echinococcus multilocularis	Excitatory amino acid transporter	0.0127	0.3971	1
Brugia malayi	RNA binding protein	0.0076	0.2074	0.301
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0287	1	1
Plasmodium vivax	thioredoxin reductase, putative	0.0084	0.2345	1
Treponema pallidum	fructose-bisphosphate aldolase	0.0287	1	1
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0191	0.6374	0.8837
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0287	1	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.2074	0.1992
Loa Loa (eye worm)	excitatory amino acid transporter	0.0127	0.3971	0.5569
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.089	0.067
Plasmodium falciparum	glutathione reductase	0.0084	0.2345	1
Echinococcus multilocularis	excitatory amino acid transporter 3	0.0127	0.3971	1
Leishmania major	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.0056	0.1319	0.5011
Schistosoma mansoni	hypothetical protein	0.0034	0.0459	0.0189
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0212	0.7175	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.089	0.1693
Mycobacterium tuberculosis	Probable reductase	0.0191	0.6374	0.8837
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0084	0.2363	0.5633
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.089	0.1693
Schistosoma mansoni	solute carrier family 1 (glial high affinity glutamate transporter	0.0127	0.3971	0.4109
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0029	0.0289	0.042
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0205	0.689	1
Trypanosoma brucei	trypanothione reductase	0.0084	0.2345	1
Loa Loa (eye worm)	hypothetical protein	0.0049	0.1042	0.1122
Giardia lamblia	Fructose-bisphosphate aldolase	0.0287	1	1
Plasmodium falciparum	thioredoxin reductase	0.0084	0.2345	1
Brugia malayi	glutathione reductase	0.0084	0.2345	0.3403
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.0056	0.1319	0.1915
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0303	0.0015
Trypanosoma cruzi	trypanothione reductase, putative	0.0084	0.2345	1
Chlamydia trachomatis	neutral amino acid transporter	0.0056	0.1314	0.2784
Brugia malayi	RNA recognition motif domain containing protein	0.0076	0.2074	0.301
Echinococcus granulosus	tar DNA binding protein	0.0076	0.2074	0.4885
Plasmodium vivax	glutathione reductase, putative	0.0084	0.2345	1
Wolbachia endosymbiont of Brugia malayi	Na+/H+-dicarboxylate symporter	0.0127	0.3971	1
Echinococcus granulosus	Excitatory amino acid transporter	0.0127	0.3971	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	7.9433 uM	PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory)	ChEMBL.	No reference

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: CHEMBL1725442

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1482071