TDR Targets

Basic information

Technical information

TDR Targets ID: 876127
Name: ethyl 2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin -3-yl)propanoate
MW: 328.386 | Formula: C17H16N2O3S
H donors: 0 H acceptors: 2 LogP: 3.22 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)C(n1cnc2c(c1=O)c(cs2)c1ccccc1)C
InChi: 1S/C17H16N2O3S/c1-3-22-17(21)11(2)19-10-18-15-14(16(19)20)13(9-23-15)12-7-5-4-6-8-12/h4-11H,3H2,1-2H3
InChiKey: PLPJKMQFLAWWJN-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

ethyl 2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoate
2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)propanoic acid ethyl ester
2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propionic acid ethyl ester
2-(4-Oxo-5-phenyl-4H-thieno[2,3-d]pyrimidin-3-yl)-propionic acid ethyl ester
BAS 04801612
ST062859

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

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
Entamoeba histolytica	deoxycytidyl transferase, putative	0.002	0.05	1
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.002	0.05	0.05
Loa Loa (eye worm)	hypothetical protein	0.0038	0.7159	0.7159
Schistosoma mansoni	thyroid hormone receptor	0.0038	0.7159	0.7159
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0038	0.7159	0.7159
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0038	0.7159	0.7159
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0038	0.7159	0.7159
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0038	0.7159	0.7159
Loa Loa (eye worm)	hypothetical protein	0.0038	0.7159	0.7159
Echinococcus multilocularis	dna polymerase eta	0.0045	1	1
Brugia malayi	nuclear receptor NHR-88	0.0038	0.7159	0.7159
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0038	0.7159	0.5
Brugia malayi	steroid hormone receptor	0.0038	0.7159	0.7159
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0038	0.7159	0.7159
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0038	0.7159	0.7159
Onchocerca volvulus	Protein ultraspiracle homolog	0.0038	0.7159	0.5
Loa Loa (eye worm)	steroid hormone receptor	0.0038	0.7159	0.7159
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0038	0.7159	0.7159
Brugia malayi	hypothetical protein	0.002	0.0623	0.0623
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.05	0.05
Loa Loa (eye worm)	hypothetical protein	0.0038	0.7159	0.7159
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.002	0.0623	0.0623
Loa Loa (eye worm)	hypothetical protein	0.0038	0.7159	0.7159
Plasmodium falciparum	ataxin-2 like protein, putative	0.0026	0.2703	1
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0038	0.7159	0.7159
Loa Loa (eye worm)	hypothetical protein	0.0038	0.7159	0.7159
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.05	0.05
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.002	0.0623	0.0623
Trypanosoma cruzi	PAB1-binding protein , putative	0.0026	0.2703	0.2703
Schistosoma mansoni	coup transcription factor	0.0038	0.7159	0.7159
Loa Loa (eye worm)	hypothetical protein	0.002	0.0623	0.0623
Brugia malayi	Nuclear hormone receptor-like 1	0.002	0.0623	0.0623
Leishmania major	DNA polymerase eta, putative	0.0032	0.5037	0.5037
Onchocerca volvulus		0.0038	0.7159	0.5
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.002	0.0623	0.0623
Schistosoma mansoni	nuclear hormone receptor	0.0038	0.7159	0.7159
Echinococcus multilocularis	FTZ F1 alpha	0.0038	0.7159	0.7159
Loa Loa (eye worm)	hypothetical protein	0.002	0.0623	0.0623
Onchocerca volvulus	Bile acid receptor homolog	0.0038	0.7159	0.5
Schistosoma mansoni	terminal deoxycytidyl transferase	0.002	0.05	0.05
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.05	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.05	0.05
Echinococcus granulosus	FTZ F1 alpha	0.0038	0.7159	0.7159
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.002	0.05	0.05
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.05	0.05
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0038	0.7159	0.7159
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.05	0.05
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0038	0.7159	0.7159
Loa Loa (eye worm)	hypothetical protein	0.002	0.0623	0.0623
Trypanosoma brucei	DNA polymerase eta, putative	0.0045	1	1
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.002	0.05	0.05
Brugia malayi	hypothetical protein	0.0026	0.2703	0.2703
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0038	0.7159	0.7159
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.05	0.05
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0038	0.7159	0.7159
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0038	0.7159	0.7159
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0038	0.7159	0.7159
Echinococcus granulosus	dna polymerase eta	0.0045	1	1
Giardia lamblia	DINP protein human, muc B family	0.002	0.05	1
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0038	0.7159	0.7159
Trypanosoma cruzi	PAB1-binding protein , putative	0.0026	0.2703	0.2703
Schistosoma mansoni	thyroid hormone receptor	0.0038	0.7159	0.7159
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0038	0.7159	0.7159
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.002	0.0623	0.0623
Loa Loa (eye worm)	hypothetical protein	0.002	0.0623	0.0623
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0038	0.7159	0.7159
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.002	0.0623	0.0623
Trypanosoma brucei	PAB1-binding protein , putative	0.0026	0.2703	0.2703
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0038	0.7159	0.7159
Trypanosoma cruzi	DNA polymerase eta, putative	0.0032	0.5037	0.5037
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0038	0.7159	0.7159
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.05	0.05
Loa Loa (eye worm)	hypothetical protein	0.0038	0.7159	0.7159
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0038	0.7159	0.7159
Loa Loa (eye worm)	hypothetical protein	0.002	0.0623	0.0623
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.002	0.05	0.05
Loa Loa (eye worm)	hypothetical protein	0.0038	0.7159	0.7159
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0038	0.7159	0.7159
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0038	0.7159	0.7159
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.05	0.05
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0038	0.7159	0.7159
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0038	0.7159	0.7159
Brugia malayi	Nuclear hormone receptor-like 1	0.0038	0.7159	0.7159
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0038	0.7159	0.7159
Brugia malayi	nuclear hormone receptor	0.0038	0.7159	0.7159
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0038	0.7159	0.7159
Echinococcus granulosus	dna polymerase kappa	0.002	0.05	0.05
Brugia malayi	photoreceptor-specific nuclear receptor	0.0038	0.7159	0.7159
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.05	0.05
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.05	0.05
Toxoplasma gondii	ImpB/MucB/SamB family protein	0.0032	0.5037	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0038	0.7159	0.7159
Loa Loa (eye worm)	hypothetical protein	0.0038	0.7159	0.7159
Brugia malayi	nuclear receptor RXR	0.002	0.0623	0.0623
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0038	0.7159	0.7159
Mycobacterium tuberculosis	Conserved hypothetical protein	0.002	0.05	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0038	0.7159	0.7159
Trypanosoma cruzi	DNA polymerase eta, putative	0.0045	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.05	0.05
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0038	0.7159	0.7159
Plasmodium falciparum	ataxin-2 like protein, putative	0.0026	0.2703	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0038	0.7159	0.7159
Echinococcus granulosus	ecdysone induced protein 78C	0.0038	0.7159	0.7159
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.05	0.05
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.05	0.05
Schistosoma mansoni	RAR-like nuclear receptor	0.0038	0.7159	0.7159
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0038	0.7159	0.7159
Plasmodium vivax	ataxin-2 like protein, putative	0.0026	0.2703	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0038	0.7159	0.7159
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0038	0.7159	0.7159
Leishmania major	hypothetical protein, conserved	0.0026	0.2703	0.2703
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.002	0.05	1
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0038	0.7159	0.7159
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0018	0	0.5
Trichomonas vaginalis	DNA polymerase eta, putative	0.002	0.05	1
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0038	0.7159	0.7159
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.05	0.05
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.05	0.05
Leishmania major	DNA polymerase kappa, putative	0.002	0.05	0.05
Schistosoma mansoni	DNA polymerase eta	0.0045	1	1
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.05	0.05
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.05	0.05
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.05	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.05	0.05
Leishmania major	DNA polymerase eta, putative	0.0045	1	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0038	0.7159	0.7159
Loa Loa (eye worm)	hypothetical protein	0.0045	1	1
Echinococcus multilocularis	ecdysone induced protein 78C	0.0038	0.7159	0.7159
Trypanosoma brucei	unspecified product	0.002	0.05	0.05
Toxoplasma gondii	LsmAD domain-containing protein	0.0026	0.2703	0.5367
Brugia malayi	Steroid receptor seven-up type 2	0.0038	0.7159	0.7159
Loa Loa (eye worm)	hypothetical protein	0.0026	0.2703	0.2703
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0018	0	0.5
Echinococcus multilocularis	dna polymerase kappa	0.002	0.05	0.05
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.002	0.05	1
Schistosoma mansoni	retinoic acid receptor RXR	0.0038	0.7159	0.7159
Brugia malayi	Nuclear hormone receptor-like 1	0.002	0.0623	0.0623
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.002	0.05	0.05
Brugia malayi	ecdysteroid receptor	0.0038	0.7159	0.7159
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0038	0.7159	0.7159
Brugia malayi	hypothetical protein	0.002	0.0623	0.0623
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0038	0.7159	0.7159
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0038	0.7159	0.7159
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0038	0.7159	0.7159

Activities

No activities found for this compound.

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

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 876127