TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 218.205 | Formula: C12H10O4
H donors: 1 H acceptors: 2 LogP: 1.75 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: COc1cc(=O)oc(c1)c1ccccc1O
InChi: 1S/C12H10O4/c1-15-8-6-11(16-12(14)7-8)9-4-2-3-5-10(9)13/h2-7,13H,1H3
InChiKey: FUNJTUFBEHVWPN-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

No synonyms found for this compound

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
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0039	0.0766	0.0742
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0083	0.1727	0.1706
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0083	0.1727	0.1706
Echinococcus granulosus	cpg binding protein	0.0032	0.0599	0.0575
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0083	0.1727	0.1726
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1727	0.1708
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1727	0.1708
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0063	0.1296	0.1295
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	0.046	1	1
Echinococcus granulosus	ecdysone induced protein 78C	0.0083	0.1727	0.1706
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0083	0.1727	0.1706
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0083	0.1727	0.1706
Loa Loa (eye worm)	hypothetical protein	0.0459	0.9985	1
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0083	0.1727	0.1706
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0007	0.007	0.0044
Brugia malayi	nuclear hormone receptor	0.0083	0.1727	0.1706
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0044	0.0869	0.0868
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Brugia malayi	nuclear receptor NHR-88	0.0039	0.0766	0.0742
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0044	0.0869	0.0845
Loa Loa (eye worm)	acetyltransferase	0.0151	0.3211	0.3198
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0139	0.2961	0.5
Echinococcus granulosus	thyroid hormone receptor alpha	0.0039	0.0766	0.0742
Schistosoma mansoni	protein kinase	0.046	1	1
Schistosoma mansoni	hypothetical protein	0.0425	0.923	0.9229
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0039	0.0766	0.0765
Brugia malayi	nuclear receptor NHR-88	0.0083	0.1727	0.1706
Echinococcus granulosus	mitogen activated protein kinase kinase kinase	0.046	1	1
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Brugia malayi	tailless protein	0.0039	0.0766	0.0742
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0056	0.0633
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Schistosoma mansoni	cpg binding protein	0.0032	0.0599	0.0598
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0007	0.0056	0.0633
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0039	0.0766	0.0742
Schistosoma mansoni	nuclear hormone receptor	0.0039	0.0766	0.0765
Echinococcus granulosus	FTZ F1 alpha	0.0083	0.1727	0.1706
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0056	0.0633
Schistosoma mansoni	RAR-like nuclear receptor	0.0083	0.1727	0.1726
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0869	0.0847
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0056	0.0633
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0056	0.0633
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0007	0.007	0.0044
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0039	0.0766	0.175
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0151	0.3211	0.3193
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0083	0.1727	0.1726
Schistosoma mansoni	nuclear hormone receptor	0.0083	0.1727	0.1726
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0039	0.0766	0.0742
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0083	0.1727	0.1708
Echinococcus granulosus	nuclear receptor nhr 48	0.0039	0.0766	0.0742
Toxoplasma gondii	histone lysine methyltransferase SET1	0.006	0.1228	1
Brugia malayi	ecdysone receptor	0.0039	0.0766	0.0742
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1727	0.1708
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0083	0.1727	0.1706
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0083	0.1727	0.1706
Schistosoma mansoni	protein kinase	0.046	1	1
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0039	0.0766	0.0743
Onchocerca volvulus	Protein ultraspiracle homolog	0.0083	0.1727	1
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0083	0.1727	0.1708
Schistosoma mansoni	thyroid hormone receptor	0.0083	0.1727	0.1726
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0039	0.0766	0.0742
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0083	0.1727	0.1726
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0083	0.1727	0.1726
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0083	0.1727	0.1706
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0083	0.1727	0.1706
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1727	0.1708
Schistosoma mansoni	retinoic acid receptor RXR	0.0083	0.1727	0.1726
Schistosoma mansoni	zinc finger protein	0.0039	0.0766	0.0765
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0083	0.1727	0.1708
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0083	0.1727	0.1706
Echinococcus multilocularis	cpg binding protein	0.0032	0.0599	0.0575
Schistosoma mansoni	nuclear hormone receptor	0.0039	0.0766	0.0765
Onchocerca volvulus	Bile acid receptor homolog	0.0083	0.1727	1
Brugia malayi	photoreceptor-specific nuclear receptor	0.0083	0.1727	0.1706
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0083	0.1727	0.1706
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0083	0.1727	0.1706
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0039	0.0766	0.0742
Echinococcus granulosus	dnaJ subfamily B	0.0425	0.923	0.9228
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0039	0.0766	0.0765
Brugia malayi	nuclear receptor RXR	0.0039	0.0766	0.0742
Brugia malayi	F/Y-rich N-terminus family protein	0.0009	0.0107	0.0082
Brugia malayi	hypothetical protein	0.0044	0.0869	0.0845
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0083	0.1727	0.1706
Brugia malayi	Steroid receptor seven-up type 2	0.0083	0.1727	0.1706
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0083	0.1727	1
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Loa Loa (eye worm)	nuclear hormone receptor	0.0039	0.0766	0.0743
Brugia malayi	conserved hypotetical protein	0.0039	0.0766	0.0742
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0056	0.0633
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0083	0.1727	0.1706
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0869	0.0847
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0056	0.0633
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0056	0.0633
Brugia malayi	Nuclear hormone receptor-like 1	0.0083	0.1727	0.1706
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Brugia malayi	hypothetical protein	0.0039	0.0766	0.0742
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1727	0.1708
Loa Loa (eye worm)	CXXC zinc finger family protein	0.003	0.0562	0.0538
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1727	0.1708
Onchocerca volvulus		0.0083	0.1727	1
Loa Loa (eye worm)	DR-78	0.0039	0.0766	0.0743
Brugia malayi	nuclear hormone receptor family member odr-7	0.0039	0.0766	0.0742
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0039	0.0766	0.0742
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0007	0.007	0.0044
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0044	0.0879	1
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1727	0.1708
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0869	0.0847
Brugia malayi	CXXC zinc finger family protein	0.003	0.0562	0.0538
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0083	0.1727	0.1706
Loa Loa (eye worm)	hypothetical protein	0.0139	0.2946	0.2933
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0039	0.0766	0.175
Brugia malayi	hypothetical protein	0.0039	0.0766	0.0742
Loa Loa (eye worm)	steroid hormone receptor	0.0083	0.1727	0.1708
Brugia malayi	hypothetical protein	0.0044	0.0869	0.0845
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0056	0.0633
Schistosoma mansoni	bromodomain containing protein	0.0005	0.0026	0.0024
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0083	0.1727	0.1726
Schistosoma mansoni	cpg binding protein	0.0032	0.0599	0.0598
Echinococcus multilocularis	FTZ F1 alpha	0.0083	0.1727	0.1706
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0039	0.0766	0.0742
Schistosoma mansoni	cpg binding protein	0.003	0.0562	0.0561
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0083	0.1727	0.1706
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0083	0.1727	0.1706
Brugia malayi	Nuclear hormone receptor E75	0.0039	0.0766	0.0742
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0083	0.1727	0.1726
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0044	0.0879	0.0855
Onchocerca volvulus		0.0039	0.0766	0.175
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0007	0.0056	0.0633
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0083	0.1727	0.1726
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0083	0.1727	0.1706
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0083	0.1727	0.1706
Schistosoma mansoni	bromodomain containing protein	0.0005	0.0026	0.0024
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0044	0.0869	0.0847
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0056	0.0633
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0139	0.2961	0.5
Echinococcus multilocularis	dnaJ subfamily B	0.0425	0.923	0.9228
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0044	0.0869	0.0845
Onchocerca volvulus		0.0039	0.0766	0.175
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0056	0.0633
Brugia malayi	ecdysteroid receptor	0.0083	0.1727	0.1706
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1727	0.1708
Brugia malayi	Nuclear hormone receptor-like 1	0.0044	0.0869	0.0845
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0039	0.0766	0.0742
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0869	0.0847
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0056	0.0633
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0083	0.1727	0.1706
Schistosoma mansoni	thyroid hormone receptor	0.0083	0.1727	0.1726
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0039	0.0766	0.0742
Schistosoma mansoni	nuclear receptor	0.0039	0.0766	0.0765
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0044	0.0869	0.0868
Schistosoma mansoni	coup transcription factor	0.0083	0.1727	0.1726
Echinococcus multilocularis	nuclear receptor nhr 48	0.0039	0.0766	0.0742
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0083	0.1727	0.1706
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0083	0.1727	0.1706
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0039	0.0766	0.0742
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0083	0.1727	0.1708
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0083	0.1727	0.1708
Schistosoma mansoni	nuclear receptor	0.0039	0.0766	0.0765
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0039	0.0766	0.0743
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0056	0.0633
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0007	0.007	0.0044
Brugia malayi	Nuclear hormone receptor-like 1	0.0044	0.0869	0.0845
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0039	0.0766	0.0742
Brugia malayi	acetyltransferase, GNAT family protein	0.0151	0.3211	0.3193
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Brugia malayi	nuclear receptor NHR-67	0.0039	0.0766	0.0742
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0007	0.007	0.0069
Loa Loa (eye worm)	histone methyltransferase	0.0009	0.011	0.0085
Brugia malayi	orphan nuclear receptor NR2E1	0.0039	0.0766	0.0742
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0146	0.3118	0.31
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0766	0.0743
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0869	0.0847
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0083	0.1727	0.1708
Plasmodium falciparum	histone acetyltransferase GCN5	0.0041	0.0798	0.5
Brugia malayi	steroid hormone receptor	0.0083	0.1727	0.1706
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0056	0.0633
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0083	0.1727	0.1706
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.011	0.0084
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0151	0.3211	0.321
Brugia malayi	nuclear receptor RXR	0.0044	0.0869	0.0845
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0083	0.1727	0.1706
Echinococcus multilocularis	ecdysone induced protein 78C	0.0083	0.1727	0.1706
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0083	0.1727	0.1706
Entamoeba histolytica	acetyltransferase, GNAT family	0.0041	0.0798	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0083	0.1727	0.1708
Loa Loa (eye worm)	STE/STE11/ASK protein kinase	0.0139	0.2961	0.2948
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0044	0.0879	1
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0044	0.0879	1
Schistosoma mansoni	nuclear receptor nhr-48	0.0039	0.0766	0.0765
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0083	0.1727	0.1706
Brugia malayi	nuclear hormone receptor	0.0039	0.0766	0.0742
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0056	0.0633
Schistosoma mansoni	zinc finger protein	0.0005	0.0026	0.0024
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.011	0.0084
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0083	0.1727	0.1706
Brugia malayi	Nuclear hormone receptor E75	0.0039	0.0766	0.0742
Giardia lamblia	Histone acetyltransferase GCN5	0.0041	0.0798	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0056	0.0633
Trichomonas vaginalis	helicase, putative	0.0007	0.0056	0.0633

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	0	Displacement of [3H]PAF from rabbit PAF receptor	ChEMBL.	17964782

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

No external resources registered for this compound

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 447603