TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 354.357 | Formula: C19H18N2O5
H donors: 5 H acceptors: 5 LogP: 1.75 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: O=C(Nc1ccc(c(c1)NC(=O)C1CC1)O)/C=C/c1ccc(c(c1)O)O
InChi: 1S/C19H18N2O5/c22-15-7-5-13(10-14(15)21-19(26)12-3-4-12)20-18(25)8-2-11-1-6-16(23)17(24)9-11/h1-2,5-10,12,22-24H,3-4H2,(H,20,25)(H,21,26)/b8-2+
InChiKey: IKKDRABNIPPQHE-KRXBUXKQSA-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

Species	Target name	Source	Bibliographic reference
Influenza A virus	Neuraminidase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Plasmodium berghei	ubiquitin-conjugating enzyme E2 N, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Trypanosoma brucei	ubiquitin-protein ligase, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Echinococcus multilocularis	ubiquitin conjugating enzyme E2 N	Get druggable targets OG5_127739	All targets in OG5_127739
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	Get druggable targets OG5_127739	All targets in OG5_127739
Trypanosoma congolense	ubiquitin-protein ligase, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	Get druggable targets OG5_127739	All targets in OG5_127739
Cryptosporidium hominis	ubiquitin-conjugating enzyme	Get druggable targets OG5_127739	All targets in OG5_127739
Schistosoma mansoni	ubiquitin conjugating enzyme 13	Get druggable targets OG5_127739	All targets in OG5_127739
Theileria parva	ubiquitin-protein ligase, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Leishmania infantum	ubiquitin-conjugating enzyme e2, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Trypanosoma cruzi	ubiquitin-conjugating enzyme E2, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Leishmania braziliensis	ubiquitin-conjugating enzyme e2, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Trypanosoma cruzi	ubiquitin-conjugating enzyme E2, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Brugia malayi	Ubiquitin conjugating enzyme protein 13	Get druggable targets OG5_127739	All targets in OG5_127739
Cryptosporidium parvum	ubiquitin-conjugating enzyme	Get druggable targets OG5_127739	All targets in OG5_127739
Candida albicans	ubiquitin conjugating enzyme	Get druggable targets OG5_127739	All targets in OG5_127739
Candida albicans	ubiquitin-conjugating enzyme	Get druggable targets OG5_127739	All targets in OG5_127739
Leishmania major	ubiquitin-conjugating enzyme e2, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Echinococcus granulosus	ubiquitin conjugating enzyme E2 N	Get druggable targets OG5_127739	All targets in OG5_127739
Leishmania donovani	ubiquitin-conjugating enzyme E2, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Leishmania mexicana	ubiquitin-conjugating enzyme e2, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Candida albicans	post-replication repair	Get druggable targets OG5_127739	All targets in OG5_127739
Entamoeba histolytica	ubiquitin-conjugating enzyme family protein	Get druggable targets OG5_127739	All targets in OG5_127739
Plasmodium vivax	ubiquitin-conjugating enzyme E2 N, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Neospora caninum	Ubiquitin carrier protein (EC 6.3.2.-), related	Get druggable targets OG5_127739	All targets in OG5_127739
Babesia bovis	ubiquitin-conjugating enzyme E2, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Trypanosoma brucei gambiense	ubiquitin-conjugating enzyme e2, putative,ubiquitin carrier protein, putative,ubiquitin-protein ligase, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Schistosoma japonicum	ko:K10580 ubiquitin-conjugating enzyme E2 N, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Brugia malayi	ubiquitin conjugating enzyme protein 13	Get druggable targets OG5_127739	All targets in OG5_127739
Plasmodium knowlesi	ubiquitin-conjugating enzyme E2 N, putative	Get druggable targets OG5_127739	All targets in OG5_127739
Toxoplasma gondii	ubiquitin-conjugating enzyme subfamily protein	Get druggable targets OG5_127739	All targets in OG5_127739
Plasmodium falciparum	ubiquitin-conjugating enzyme E2 N, putative	Get druggable targets OG5_127739	All targets in OG5_127739

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
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0027	0.0454	0.0454
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	0.0046	0.0879	0.1553
Trypanosoma brucei	ubiquitin-protein ligase, putative	0.0046	0.0879	0.3231
Echinococcus granulosus	roundabout 2	0.0009	0.0042	0.0093
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0211	0.4554	1
Echinococcus multilocularis	roundabout 2	0.0009	0.0042	0.0093
Brugia malayi	protein-tyrosine phosphatase Lar-like precursor, putative	0.0018	0.0264	0.0264
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0423	0.0403
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0279	0.0259
Echinococcus granulosus	roundabout 2	0.0009	0.0042	0.0093
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0024	0.0384	0.0844
Mycobacterium tuberculosis	holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie	0.0025	0.0415	0.3055
Trypanosoma cruzi	tyrosine specific protein phosphatase, putative	0.0018	0.0264	0.0918
Brugia malayi	AMP-binding enzyme family protein	0.0008	0.002	0.002
Schistosoma mansoni	cell adhesion molecule	0.0009	0.0042	0.0042
Trypanosoma cruzi	protein tyrosine phosphatase PRL	0.0022	0.0334	0.1182
Onchocerca volvulus	Ectonucleotide pyrophosphatase\/phosphodiesterase family member 6 homolog	0.0033	0.0592	0.0573
Mycobacterium ulcerans	hypothetical protein	0.0026	0.0423	0.3115
Brugia malayi	hypothetical protein	0.0033	0.0592	0.0592
Onchocerca volvulus		0.0256	0.5547	0.5538
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0042	0.0022
Echinococcus granulosus	L aminoadipate semialdehyde	0.009	0.1851	0.4066
Schistosoma mansoni	hypothetical protein	0.0456	1	1
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0009	0.0042	0.0022
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0211	0.4554	1
Echinococcus granulosus	acetyl coenzyme A synthetase cytoplasmic	0.0008	0.002	0.0045
Trypanosoma cruzi	protein tyrosine phosphatase-like protein, putative	0.0022	0.0334	0.1182
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0211	0.4554	0.4554
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0249	0.0229
Schistosoma mansoni	hypothetical protein	0.0044	0.0832	0.0832
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0256	0.182
Onchocerca volvulus	Ectonucleotide pyrophosphatase\/phosphodiesterase family member 7 homolog	0.0033	0.0592	0.0573
Brugia malayi	Type I phosphodiesterase / nucleotide pyrophosphatase family protein	0.0211	0.4554	0.4554
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0423	0.0423
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	0.0046	0.0879	0.086
Trichomonas vaginalis	set domain proteins, putative	0.0256	0.5547	1
Echinococcus granulosus	Endonuclease G	0.0127	0.2677	0.5879
Trypanosoma brucei	endonuclease G, putative	0.0127	0.2677	1
Toxoplasma gondii	hypothetical protein	0.0019	0.027	0.0939
Loa Loa (eye worm)	hypothetical protein	0.0178	0.3814	0.3802
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0027	0.0454	0.0996
Trypanosoma brucei	endonuclease G, putative	0.0127	0.2677	1
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0211	0.4554	1
Echinococcus multilocularis	Niemann Pick C1 protein	0.0152	0.3235	0.7104
Loa Loa (eye worm)	thrombospondin type 1 domain-containing protein	0.0456	1	1
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0019	0.0279	0.2
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0026	0.0423	0.7038
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0178	0.3814	0.8376
Mycobacterium ulcerans	phosphopantetheinyl transferase, PptII	0.0025	0.0415	0.3055
Entamoeba histolytica	ubiquitin-conjugating enzyme family protein	0.0046	0.0879	0.3903
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0021	0.033	0.033
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0237	0.0218
Schistosoma mansoni	hypothetical protein	0.0044	0.0832	0.0832
Schistosoma mansoni	neuroglian	0.0009	0.0042	0.0042
Echinococcus granulosus	Niemann Pick C1 protein	0.0152	0.3235	0.7104
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0225	0.4856	0.4845
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0256	0.182
Schistosoma mansoni	hypothetical protein	0.0033	0.0592	0.0592
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0256	0.182
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0033	0.0592	0.0592
Echinococcus multilocularis	expressed conserved protein	0.01	0.2076	0.4559
Schistosoma mansoni	aldehyde dehydrogenase	0.0066	0.1313	0.1313
Echinococcus multilocularis	L aminoadipate semialdehyde	0.009	0.1851	0.4066
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0066	0.1313	0.2882
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0211	0.4554	1
Trypanosoma cruzi	protein tyrosine phosphatase-like protein, putative	0.0022	0.0334	0.1182
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0571	0.0551
Schistosoma mansoni	cell adhesion molecule	0.0009	0.0042	0.0042
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0026	0.0423	0.3115
Leishmania major	endonuclease G, putative	0.0127	0.2677	1
Schistosoma mansoni	acetyl-CoA synthetase	0.0008	0.002	0.002
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	0.009	0.1851	0.1851
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0211	0.4554	1
Echinococcus multilocularis	Endonuclease G	0.0127	0.2677	0.5879
Plasmodium vivax	protein tyrosine phosphatase, putative	0.0022	0.0334	0.3659
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0032	0.0571	0.1253
Schistosoma mansoni	aldehyde dehydrogenase	0.0066	0.1313	0.1313
Leishmania major	DNA/RNA non-specific endonuclease-like protein	0.0127	0.2677	1
Toxoplasma gondii	DNA/RNA non-specific endonuclease	0.0127	0.2677	1
Echinococcus multilocularis	neuroglian	0.0009	0.0042	0.0093
Echinococcus granulosus	histone lysine methyltransferase setb	0.0032	0.0571	0.1253
Brugia malayi	Ubiquitin conjugating enzyme protein 13	0.0046	0.0879	0.0879
Schistosoma mansoni	patched 1	0.0046	0.0869	0.0869
Schistosoma mansoni	hypothetical protein	0.0044	0.0832	0.0832
Brugia malayi	Pre-SET motif family protein	0.0225	0.4856	0.4856
Plasmodium falciparum	protein tyrosine phosphatase	0.0022	0.0334	0.3659
Trypanosoma cruzi	protein tyrosine phosphatase, putative	0.0022	0.0334	0.1182
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0211	0.4554	1
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0021	0.033	0.033
Brugia malayi	Niemann-Pick C1 protein precursor	0.0106	0.222	0.222
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0423	0.3115
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0019	0.0279	0.2
Onchocerca volvulus	GPI ethanolamine phosphate transferase 1 homolog	0.0033	0.0592	0.0573
Echinococcus multilocularis	gpi ethanolamine phosphate transferase 3	0.0033	0.0592	0.1301
Echinococcus multilocularis	contactin neuroglian septate junction protein	0.0009	0.0042	0.0093
Echinococcus granulosus	ectonucleotide	0.0178	0.3814	0.8376
Leishmania major	tyrosine specific protein phosphatase, putative	0.0018	0.0264	0.0918
Trypanosoma cruzi	tyrosine specific protein phosphatase, putative	0.0018	0.0264	0.0918
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0106	0.222	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0066	0.1313	1
Brugia malayi	Pre-SET motif family protein	0.0032	0.0571	0.0571
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0211	0.4554	1
Mycobacterium leprae	hypothetical protein	0.0033	0.0592	1
Echinococcus multilocularis	acetyl coenzyme A synthetase, cytoplasmic	0.0008	0.002	0.0045
Toxoplasma gondii	4'-phosphopantetheinyl transferase domain-containing protein	0.0025	0.0415	0.1486
Brugia malayi	CHE-14 protein	0.0046	0.0869	0.0869
Trypanosoma brucei	endonuclease G, putative	0.0127	0.2677	1
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0592	0.0573
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0066	0.1313	0.2882
Mycobacterium ulcerans	hypothetical protein	0.0033	0.0592	0.4427
Mycobacterium leprae	conserved hypothetical protein	0.0025	0.0415	0.6901
Echinococcus multilocularis	roundabout 2	0.0009	0.0042	0.0093
Brugia malayi	Dual specificity protein phosphatase CDC14B	0.0022	0.0351	0.0351
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0032	0.0571	0.2071
Entamoeba histolytica	acyl-coA synthetase, putative	0.0026	0.0423	0.183
Loa Loa (eye worm)	CAMK/MLCK protein kinase	0.0009	0.0042	0.0022
Onchocerca volvulus		0.0018	0.0264	0.0244
Loa Loa (eye worm)	hypothetical protein	0.0056	0.1097	0.1079
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0571	0.0571
Echinococcus granulosus	protein tyrosine phosphatase PRL	0.0022	0.0334	0.0734
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0592	0.0573
Trichomonas vaginalis	conserved hypothetical protein	0.0046	0.0869	0.1535
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0018	0.0264	0.0581
Leishmania major	ubiquitin-conjugating enzyme e2, putative	0.0046	0.0879	0.3231
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0046	0.0869	0.085
Echinococcus multilocularis	sterol regulatory element binding protein	0.0046	0.0869	0.1908
Trichomonas vaginalis	conserved hypothetical protein	0.0019	0.027	0.0451
Echinococcus multilocularis	protein patched	0.0046	0.0869	0.1908
Leishmania major	phosphopantetheinyl transferase-like protein	0.0025	0.0415	0.1486
Trypanosoma brucei	GPI ethanolamine phosphate transferase 3, putative	0.0033	0.0592	0.2153
Schistosoma mansoni	hypothetical protein	0.0044	0.0832	0.0832
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0032	0.0571	0.1253
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0571	0.0571
Loa Loa (eye worm)	hypothetical protein	0.0211	0.4554	0.4542
Echinococcus granulosus	sterol regulatory element binding protein	0.0046	0.0869	0.1908
Echinococcus multilocularis	Niemann Pick C1 protein	0.0106	0.222	0.4874
Echinococcus granulosus	ubiquitin conjugating enzyme E2 N	0.0046	0.0879	0.193
Trypanosoma cruzi	protein tyrosine phosphatase, putative	0.0022	0.0334	0.1182
Onchocerca volvulus		0.0211	0.4554	0.4542
Echinococcus multilocularis	roundabout 2	0.0009	0.0042	0.0093
Echinococcus multilocularis	transferase	0.0033	0.0592	0.1301
Trypanosoma cruzi	endonuclease G, putative	0.0127	0.2677	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0279	0.0259
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0211	0.4554	0.4554
Leishmania major	protein tyrosine phosphatase-like protein	0.0022	0.0334	0.1182
Loa Loa (eye worm)	type I phosphodiesterase/nucleotide pyrophosphatase	0.0033	0.0592	0.0573
Loa Loa (eye worm)	hypothetical protein	0.0211	0.4554	0.4542
Entamoeba histolytica	hypothetical protein	0.0025	0.0415	0.1795
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0211	0.4554	0.4554
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0026	0.0423	0.3115
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0423	0.1515
Schistosoma mansoni	protein tyrosine phosphatase prl	0.0022	0.0334	0.0334
Loa Loa (eye worm)	hypothetical protein	0.0106	0.222	0.2204
Plasmodium falciparum	ubiquitin-conjugating enzyme E2 N, putative	0.0046	0.0879	1
Brugia malayi	AMP-binding enzyme family protein	0.0008	0.002	0.002
Chlamydia trachomatis	holo [acyl-carrier protein] synthase	0.0025	0.0415	1
Trypanosoma cruzi	protein tyrosine phosphatase-like protein, putative	0.0022	0.0334	0.1182
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0026	0.0423	0.183
Trypanosoma cruzi	protein tyrosine phosphatase-like protein, putative	0.0022	0.0334	0.1182
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0423	0.0423
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0032	0.0571	0.0571
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0033	0.0592	0.1301
Giardia lamblia	Phosphatidylinositol-glycan biosynthesis, class O protein	0.0033	0.0592	0.5
Brugia malayi	AMP-binding enzyme family protein	0.0008	0.002	0.002
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0008	0.002	0.002
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0021	0.033	0.0725
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	0.009	0.1851	0.1851
Brugia malayi	ubiquitin conjugating enzyme protein 13	0.0046	0.0879	0.0879
Plasmodium vivax	holo-[acyl-carrier-protein] synthase, putative	0.0025	0.0415	0.4599
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0869	0.085
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0423	0.3115
Loa Loa (eye worm)	hypothetical protein	0.009	0.1851	0.1835
Echinococcus granulosus	roundabout 2	0.0009	0.0042	0.0093
Toxoplasma gondii	ubiquitin-conjugating enzyme subfamily protein	0.0046	0.0879	0.3231
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0279	0.0259
Onchocerca volvulus	GPI ethanolamine phosphate transferase 2 homolog	0.0033	0.0592	0.0573
Echinococcus granulosus	Protein patched homolog 1	0.0046	0.0869	0.1908
Plasmodium falciparum	GPI ethanolamine phosphate transferase 3, putative	0.0033	0.0592	0.6664
Trypanosoma cruzi	DNA/RNA non-specific endonuclease protein-like, putative	0.0127	0.2677	1
Treponema pallidum	4'-phosphopantetheinyl transferase	0.0025	0.0415	0.5
Echinococcus multilocularis	protein dispatched 1	0.0052	0.1012	0.2223
Echinococcus multilocularis	receptor type tyrosine protein phosphatase F	0.0027	0.0454	0.0996
Schistosoma mansoni	hypothetical protein	0.0033	0.0592	0.0592
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0018	0.0264	0.0581
Plasmodium falciparum	acyl-CoA synthetase	0.0019	0.0279	0.3012
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0066	0.1313	1
Schistosoma mansoni	ubiquitin conjugating enzyme 13	0.0046	0.0879	0.0879
Echinococcus granulosus	gpi ethanolamine phosphate transferase 3	0.0033	0.0592	0.1301
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0279	0.0259
Leishmania major	protein tyrosine phosphatase-likie protein	0.0022	0.0334	0.1182
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0033	0.0592	0.1301
Leishmania major	ethanolamine phosphotransferase, putative	0.0033	0.0592	0.2153
Echinococcus multilocularis	gpi ethanolamine phosphate transferase 1	0.0033	0.0592	0.1301
Onchocerca volvulus		0.0026	0.0423	0.0403
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0027	0.0454	0.0996
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0066	0.1313	1
Schistosoma mansoni	protein tyrosine phosphatase prl	0.0022	0.0334	0.0334
Brugia malayi	acetyl-Coenzyme A synthetase 2	0.0008	0.002	0.002
Plasmodium vivax	acyl-CoA synthetase, putative	0.0019	0.0279	0.3012
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0211	0.4554	1
Trypanosoma cruzi	endonuclease G, putative	0.0127	0.2677	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0066	0.1313	1
Onchocerca volvulus		0.0456	1	1
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0027	0.0454	0.0996
Echinococcus granulosus	contactin	0.0009	0.0042	0.0093
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0211	0.4554	1
Schistosoma mansoni	nephrin	0.0009	0.0042	0.0042
Loa Loa (eye worm)	fibronectin type III domain-containing protein	0.0021	0.033	0.031
Plasmodium falciparum	holo-[acyl-carrier-protein] synthase, putative	0.0025	0.0415	0.4599
Toxoplasma gondii	aldehyde dehydrogenase	0.0066	0.1313	0.4864
Schistosoma mansoni	hypothetical protein	0.0033	0.0592	0.0592
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0423	0.0403
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0009	0.0042	0.0042
Plasmodium vivax	ubiquitin-conjugating enzyme E2 N, putative	0.0046	0.0879	1
Trypanosoma cruzi	ubiquitin-conjugating enzyme E2, putative	0.0046	0.0879	0.3231
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0279	0.0259
Plasmodium vivax	SET domain protein, putative	0.0032	0.0571	0.6411
Trypanosoma cruzi	protein tyrosine phosphatase, putative	0.0022	0.0334	0.1182
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	0.0046	0.0879	0.1553
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.0021	0.033	0.0725
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0571	0.0571
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0022	0.0334	0.1428
Toxoplasma gondii	4'-phosphopantetheinyl transferase superfamily protein	0.0025	0.0415	0.1486
Trypanosoma cruzi	DNA/RNA non-specific endonuclease protein-like, putative	0.0127	0.2677	1
Echinococcus granulosus	Niemann Pick C1 protein	0.0106	0.222	0.4874
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0066	0.1313	0.4864
Onchocerca volvulus		0.0012	0.0113	0.0093
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0423	0.3115
Onchocerca volvulus	GPI ethanolamine phosphate transferase 3 homolog	0.0033	0.0592	0.0573
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0108	0.2256	0.2256
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0026	0.0423	0.7038
Echinococcus multilocularis	protein tyrosine phosphatase PRL	0.0022	0.0334	0.0734
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0178	0.3814	0.8376
Brugia malayi	AEL166Cp	0.0033	0.0592	0.0592
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0026	0.0423	0.3115
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0423	0.1515
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0009	0.0042	0.0042
Schistosoma mansoni	hypothetical protein	0.0033	0.0592	0.0592
Brugia malayi	hypothetical protein	0.0033	0.0592	0.0592
Echinococcus multilocularis	ubiquitin conjugating enzyme E2 N	0.0046	0.0879	0.193
Echinococcus multilocularis	sortilin receptor	0.0015	0.0183	0.0402
Trypanosoma brucei	phosphatase of regenerating liver-type phosphatase, putative	0.0022	0.0334	0.1182
Mycobacterium ulcerans	4'-phosphopantetheinyl transferase	0.0025	0.0415	0.3055
Entamoeba histolytica	phosphatidylinositol-glycan biosynthesis class O protein, putative	0.0033	0.0592	0.2601
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0256	0.182
Echinococcus granulosus	expressed conserved protein	0.01	0.2076	0.4559
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0026	0.0423	0.3115
Loa Loa (eye worm)	dual specificity protein phosphatase CDC14B	0.0022	0.0351	0.0331
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0026	0.0423	0.3115
Echinococcus multilocularis	ectonucleotide	0.0178	0.3814	0.8376
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0033	0.0592	0.1301
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	0.0046	0.0879	0.086
Onchocerca volvulus		0.0211	0.4554	0.4542
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0211	0.4554	0.4554
Trypanosoma cruzi	ubiquitin-conjugating enzyme E2, putative	0.0046	0.0879	0.3231
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0211	0.4554	1
Trypanosoma brucei	hypothetical protein, conserved	0.0025	0.0415	0.1486
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0423	0.0423
Echinococcus granulosus	neuroglian	0.0009	0.0042	0.0093
Onchocerca volvulus		0.009	0.1851	0.1835
Brugia malayi	AMP-binding enzyme family protein	0.0008	0.002	0.002
Entamoeba histolytica	phosphatidylinositol-glycan biosynthesis class O protein, putative	0.0033	0.0592	0.2601
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0423	0.1515
Brugia malayi	Type I phosphodiesterase / nucleotide pyrophosphatase family protein	0.0033	0.0592	0.0592
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0211	0.4554	1
Wolbachia endosymbiont of Brugia malayi	4'-phosphopantetheinyl transferase	0.0025	0.0415	0.5
Schistosoma mansoni	endonuclease related	0.0127	0.2677	0.2677
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0026	0.0423	0.3115
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0026	0.0423	0.183
Echinococcus granulosus	transferase	0.0033	0.0592	0.1301
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0031	0.0544	0.1195
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0018	0.0264	0.0581
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0009	0.0042	0.0042
Loa Loa (eye worm)	hypothetical protein	0.0211	0.4554	0.4542
Echinococcus multilocularis	Alkaline phosphatase, core domain	0.0033	0.0592	0.1301
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0592	0.0573
Brugia malayi	endonuclease G, mitochondrial precursor	0.0127	0.2677	0.2677
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0592	0.0573
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0423	0.0403
Onchocerca volvulus		0.0032	0.0571	0.0551

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 18.2 uM	Inhibition of Influenza A virus H1N1 A/duck/China/QJ/01 neuraminidase N1 using 4-MU-NANA as substrate after 5 mins by fluorescence assay	ChEMBL.	23664211
IC50 (binding)	= 24.7 uM	Inhibition of Influenza A virus (A/chicken/Sandong/Li/2008(H9N2)) neuraminidase N2 using 4-MU-NANA as substrate after 5 mins by fluorescence assay	ChEMBL.	23664211

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.

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External resources for this compound

ChEMBL: CHEMBL2392258

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1782368