TDR Targets

Basic information

Technical information

TDR Targets ID: 1477555
Name: ZINC05111946
MW: 262.218 | Formula: C12H10N2O5
H donors: 3 H acceptors: 5 LogP: 1.87 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: Oc1nc(O)c(c(n1)O)Cc1ccc2c(c1)OCO2
InChi: 1S/C12H10N2O5/c15-10-7(11(16)14-12(17)13-10)3-6-1-2-8-9(4-6)19-5-18-8/h1-2,4H,3,5H2,(H3,13,14,15,16,17)
InChiKey: PTOXLYWCDPIGQR-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
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0365	0.0844
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0088	0.0479
Trypanosoma cruzi	polo-like protein kinase, putative	0.0092	0.0979	0.1514
Brugia malayi	hypothetical protein	0.0026	0.0132	0.0108
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0.0088	0.0552
Trypanosoma brucei	Dipeptidyl-peptidase 8-like, putative	0.0336	0.4136	1
Brugia malayi	prolyl oligopeptidase family protein	0.0048	0.0415	0.0798
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0109	0.1198	0.2743
Leishmania major	prolyl oligopeptidase, putative,serine peptidase clan SC, family S9A, putative	0.0048	0.0415	0.0809
Echinococcus granulosus	expressed conserved protein	0.009	0.0954	0.2024
Giardia lamblia	Kinase, PLK	0.0092	0.0979	0.1845
Echinococcus multilocularis	muscleblind protein 1	0.0145	0.167	0.1559
Schistosoma mansoni	serine/threonine protein kinase	0.0092	0.0979	0.2086
Echinococcus multilocularis	Dipeptidyl peptidase 9	0.0336	0.4136	0.4058
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0109	0.1198	0.2105
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.3469	1
Entamoeba histolytica	hypothetical protein, conserved	0.0048	0.0415	0.0968
Trichomonas vaginalis	CAMK family protein kinase	0.0092	0.0979	0.2088
Echinococcus multilocularis	dipeptidyl aminopeptidaseprotein	0.034	0.4192	0.4114
Brugia malayi	jmjC domain containing protein	0.0057	0.053	0.1077
Trichomonas vaginalis	CAMK family protein kinase	0.0092	0.0979	0.2088
Brugia malayi	hypothetical protein	0.0157	0.1818	0.4217
Trichomonas vaginalis	CAMK family protein kinase	0.0092	0.0979	0.2088
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0415	0.0964
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0092	0.0979	0.2312
Brugia malayi	Niemann-Pick C1 protein precursor	0.0096	0.1029	0.2293
Onchocerca volvulus	Serine\/threonine kinase homolog	0.0092	0.0979	0.2171
Entamoeba histolytica	prolyl oligopeptidase family protein	0.0048	0.0415	0.0968
Trypanosoma brucei	serine peptidase, Clan SC, Family S9B	0.0336	0.4136	1
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0109	0.1198	0.2743
Loa Loa (eye worm)	hypothetical protein	0.0179	0.2107	0.5011
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0321	0.0739
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0049	0.0417	0.0968
Trichomonas vaginalis	CAMK family protein kinase	0.0092	0.0979	0.2088
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0132	0.0286
Schistosoma mansoni	hypothetical protein	0.004	0.0302	0.0419
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0109	0.1198	0.2105
Mycobacterium ulcerans	protease II (oligopeptidase B), PtrB	0.0048	0.0415	0.2558
Echinococcus multilocularis	lysine specific demethylase 5A	0.0057	0.053	0.0403
Mycobacterium tuberculosis	Probable peptidase	0.0048	0.0415	0.2616
Trichomonas vaginalis	Clan SC, family S9, acylaminoacyl-peptidase-like serine peptidase	0.0048	0.0415	0.0298
Schistosoma mansoni	acylaminoacyl-peptidase (S09 family)	0.0048	0.0415	0.0698
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0139	0.1587	1
Echinococcus granulosus	lysine specific demethylase 5A	0.0057	0.053	0.098
Leishmania major	dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B	0.0336	0.4136	1
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.0048	0.0415	0.0698
Trypanosoma brucei	calpain, putative	0.0109	0.1198	0.2105
Trypanosoma brucei	cysteine peptidase, Clan CA, family C2, putative	0.0109	0.1198	0.2105
Echinococcus multilocularis	prolyl endopeptidase	0.0048	0.0415	0.0287
Echinococcus multilocularis	sterol regulatory element binding protein	0.0041	0.0321	0.0192
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	0.0088	0.0479
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	0.0088	0.0479
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.3469	1
Leishmania major	oligopeptidase B-like protein,serine peptidase, clan SC, family S9A-like protein	0.0048	0.0415	0.0809
Trypanosoma cruzi	calpain cysteine peptidase, putative	0.0109	0.1198	0.2105
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0048	0.0415	0.0298
Brugia malayi	prolyl oligopeptidase family protein	0.0336	0.4136	0.9864
Schistosoma mansoni	subfamily S9B unassigned peptidase (S09 family)	0.034	0.4192	1
Echinococcus multilocularis	geminin	0.0205	0.2437	0.2336
Loa Loa (eye worm)	hypothetical protein	0.0157	0.1818	0.4322
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0109	0.1198	0.2105
Brugia malayi	serine/threonine-protein kinase plk-2	0.0092	0.0979	0.2171
Loa Loa (eye worm)	prolyl oligopeptidase	0.034	0.4192	1
Entamoeba histolytica	serine/threonine protein kinase, putative	0.0092	0.0979	0.2634
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0088	0.0479
Brugia malayi	prolyl oligopeptidase family protein	0.0048	0.0415	0.0798
Echinococcus granulosus	geminin	0.0205	0.2437	0.5677
Loa Loa (eye worm)	jmjC domain-containing protein	0.0057	0.053	0.1238
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0041	0.0321	0.0739
Schistosoma mansoni	hypothetical protein	0.004	0.0302	0.0419
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0109	0.1198	0.2105
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0218	0.0493
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.0218	0.0318
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0365	0.0575
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0284	0.3469	1
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0057	0.053	0.0403
Brugia malayi	jmjC domain containing protein	0.0057	0.053	0.1077
Entamoeba histolytica	prolyl oligopeptidase family protein	0.0048	0.0415	0.0968
Echinococcus granulosus	Protein patched homolog 1	0.0041	0.0321	0.0467
Trypanosoma cruzi	dipeptidyl-peptidase 8-like serine peptidase	0.0336	0.4136	1
Toxoplasma gondii	dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein	0.0205	0.2444	1
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0139	0.1587	1
Trypanosoma brucei	hypothetical protein	0.0109	0.1198	0.2105
Trichomonas vaginalis	CAMK family protein kinase	0.0046	0.0378	0.018
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0109	0.1198	0.2105
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0057	0.053	0.098
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0109	0.1198	0.2105
Schistosoma mansoni	hypothetical protein	0.004	0.0302	0.0419
Entamoeba histolytica	dipeptidyl-peptidase, putative	0.0048	0.0415	0.0968
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0365	0.0676
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0092	0.0979	0.2201
Mycobacterium leprae	PROBABLE PROTEASE II PTRBB (OLIGOPEPTIDASE B)	0.0048	0.0415	0.2184
Trypanosoma brucei	polo-like protein kinase	0.0092	0.0979	0.1514
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0365	0.0237
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0109	0.1198	0.2105
Leishmania major	oligopeptidase b	0.0048	0.0415	0.0809
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0415	0.0964
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0365	0.0575
Schistosoma mansoni	hypothetical protein	0.0205	0.2437	0.5677
Brugia malayi	prolyl oligopeptidase family protein	0.0048	0.0415	0.0798
Loa Loa (eye worm)	hypothetical protein	0.005	0.0441	0.1026
Echinococcus granulosus	acylamino acid releasing enzyme	0.0048	0.0415	0.0698
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.3469	1
Echinococcus granulosus	Niemann Pick C1 protein	0.0137	0.1561	0.352
Echinococcus granulosus	dipeptidyl aminopeptidaseprotein	0.034	0.4192	1
Brugia malayi	prolyl oligopeptidase family protein	0.034	0.4192	1
Echinococcus multilocularis	Niemann Pick C1 protein	0.0137	0.1561	0.1448
Onchocerca volvulus	Dipeptidyl peptidase family member 1 homolog	0.034	0.4192	1
Brugia malayi	CHE-14 protein	0.0041	0.0321	0.0569
Trichomonas vaginalis	CAMK family protein kinase	0.0092	0.0979	0.2088
Echinococcus granulosus	prolyl endopeptidase	0.0048	0.0415	0.0698
Plasmodium vivax	hypothetical protein, conserved	0.0048	0.0415	1
Onchocerca volvulus	Prolyl endopeptidase homolog	0.0048	0.0415	0.0798
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	0.0088	0.0479
Entamoeba histolytica	prolyl oligopeptidase family protein	0.0048	0.0415	0.0968
Echinococcus granulosus	Dipeptidyl peptidase 9	0.0336	0.4136	0.9862
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.0048	0.0415	0.0698
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0284	0.3469	1
Loa Loa (eye worm)	hypothetical protein	0.0145	0.167	0.3967
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	0.0088	0.0479
Echinococcus multilocularis	protein patched	0.0041	0.0321	0.0192
Loa Loa (eye worm)	hypothetical protein	0.0145	0.167	0.3967
Trypanosoma cruzi	serine peptidase, Clan SC, Family S9B	0.0336	0.4136	1
Trichomonas vaginalis	CAMK family protein kinase	0.0092	0.0979	0.2088
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0097	0.1048	0.2257
Loa Loa (eye worm)	prolyl oligopeptidase	0.0048	0.0415	0.0964
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0049	0.0417	0.0802
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.3469	1
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0417	0.0968
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.3469	1
Trichomonas vaginalis	conserved hypothetical protein	0.0048	0.0415	0.0298
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0088	0.0181
Mycobacterium tuberculosis	Probable protease II PtrBb [second part] (oligopeptidase B)	0.0048	0.0415	0.2616
Trypanosoma brucei	variant surface glycoprotein (VSG), putative	0.0109	0.1198	0.2105
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.3469	1
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0057	0.053	0.098
Trypanosoma brucei	calpain-like protein, putative	0.0109	0.1198	0.2105
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0365	0.0575
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0057	0.053	0.098
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.0048	0.0415	0.0698
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0365	0.0575
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0109	0.1198	0.2105
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.3469	1
Brugia malayi	Temporarily assigned gene name protein 44	0.0026	0.0132	0.0108
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0017	0.0012	0.0077
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0096	0.1029	0.2783
Brugia malayi	Muscleblind-like protein	0.0145	0.167	0.3856
Giardia lamblia	Fructose-bisphosphate aldolase	0.0284	0.3469	1
Echinococcus granulosus	Niemann Pick C1 protein	0.0096	0.1029	0.221
Schistosoma mansoni	kinase	0.0047	0.0394	0.0645
Treponema pallidum	fructose-bisphosphate aldolase	0.0284	0.3469	0.5
Echinococcus multilocularis	Niemann Pick C1 protein	0.0096	0.1029	0.0909
Plasmodium falciparum	peptidase, putative	0.0048	0.0415	1
Mycobacterium ulcerans	hypothetical protein	0.0023	0.0088	0.0479
Echinococcus granulosus	sterol regulatory element binding protein	0.0041	0.0321	0.0467
Loa Loa (eye worm)	tumor suppressor	0.0313	0.3839	0.9155
Schistosoma mansoni	hypothetical protein	0.004	0.0302	0.0419
Trichomonas vaginalis	CAMK family protein kinase	0.0092	0.0979	0.2088
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0.0088	0.0552
Echinococcus granulosus	muscleblind protein	0.0145	0.167	0.3789
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0365	0.0237
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.3469	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0049	0.0417	0.0802
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0092	0.0979	0.2086
Echinococcus multilocularis	acylamino acid releasing enzyme	0.0048	0.0415	0.0287
Schistosoma mansoni	patched 1	0.0041	0.0321	0.0467
Entamoeba histolytica	dipeptidyl-peptidase, putative	0.0048	0.0415	0.0968
Loa Loa (eye worm)	hypothetical protein	0.0096	0.1029	0.2432
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0088	0.0181
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0017	0.0012	0.5
Echinococcus multilocularis	muscleblind protein	0.0145	0.167	0.1559
Trichomonas vaginalis	CAMK family protein kinase	0.0046	0.0378	0.018
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0088	0.0479
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0092	0.0979	0.0858
Schistosoma mansoni	hypothetical protein	0.0033	0.0218	0.0213
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0088	0.0181
Schistosoma mansoni	jumonji domain containing protein	0.0057	0.053	0.098
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0139	0.1587	1
Schistosoma mansoni	hypothetical protein	0.0205	0.2437	0.5677
Echinococcus multilocularis	protein dispatched 1	0.0047	0.0396	0.0268
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0109	0.1198	0.2743
Echinococcus multilocularis	expressed conserved protein	0.009	0.0954	0.0833
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0365	0.0575
Trypanosoma cruzi	polo-like protein kinase, putative	0.0092	0.0979	0.1514
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0109	0.1198	0.2105
Schistosoma mansoni	dipeptidyl-peptidase 9 (S09 family)	0.0336	0.4136	0.9862
Brugia malayi	tumor suppressor.	0.0313	0.3839	0.9139

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

ChEMBL: CHEMBL1620204

Bibliographic References

No literature references available for this target.

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

Detailed information for compound 1477555