TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 362.42 | Formula: C19H26N2O5
H donors: 0 H acceptors: 3 LogP: 1.1 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: COC(=O)CN(C(=O)C1CCC(=O)N(C1)CCc1ccc(cc1)OC)C
InChi: 1S/C19H26N2O5/c1-20(13-18(23)26-3)19(24)15-6-9-17(22)21(12-15)11-10-14-4-7-16(25-2)8-5-14/h4-5,7-8,15H,6,9-13H2,1-3H3
InChiKey: FSTHFOONKJRZTL-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
Schistosoma mansoni	single-minded	0.0049	0.007	0.0246
Onchocerca volvulus	Ubiquitin thioesterase ZRANB1 homolog	0.016	0.044	0.3132
Echinococcus multilocularis	geminin	0.0176	0.049	0.0488
Loa Loa (eye worm)	hypothetical protein	0.0257	0.0758	0.2731
Echinococcus multilocularis	isocitrate dehydrogenase	0.0033	0.0019	0.0018
Schistosoma mansoni	zinc finger protein	0.016	0.044	0.1579
Loa Loa (eye worm)	intermediate filament protein	0.0028	0.0002	0.0006
Echinococcus multilocularis	transcription factor btf3	0.0038	0.0033	0.0032
Schistosoma mansoni	fusion	0.016	0.044	0.1579
Trypanosoma cruzi	WLM domain containing protein, putative	0.016	0.044	0.1525
Brugia malayi	SWIB/MDM2 domain containing protein	0.0451	0.14	0.5042
Trypanosoma brucei	hypothetical protein, conserved	0.016	0.044	0.1525
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0002	0.0006
Brugia malayi	hypothetical protein	0.0163	0.0448	0.1609
Brugia malayi	Doublecortin family protein	0.0042	0.0047	0.0163
Trypanosoma brucei	hypothetical protein, conserved	0.016	0.044	0.1525
Plasmodium falciparum	SWIB/MDM2 domain-containing protein	0.0451	0.14	1
Echinococcus multilocularis	SWI:SNF matrix associated	0.0451	0.14	0.1399
Trypanosoma cruzi	transcription factor btf3, putative	0.0038	0.0033	0.005
Brugia malayi	hypothetical protein	0.0042	0.0047	0.0163
Loa Loa (eye worm)	transcription factor SMAD2	0.0243	0.0712	0.2567
Trypanosoma cruzi	mitochondrial RNA binding complex 1 subunit, putative	0.016	0.044	0.1525
Loa Loa (eye worm)	hypothetical protein	0.0258	0.0764	0.2752
Trichomonas vaginalis	glucosylceramidase, putative	0.0535	0.1678	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0049	0.0072	0.007
Brugia malayi	Isocitrate dehydrogenase	0.0033	0.0019	0.0064
Brugia malayi	brahma associated protein 60 kDa	0.0451	0.14	0.5042
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0042	0.0047	0.0045
Echinococcus multilocularis	SWI:SNF matrix associated	0.0451	0.14	0.1399
Entamoeba histolytica	Acid sphingomyelinase-like phosphodiesterase, putative	0.0257	0.0758	0.2645
Schistosoma mansoni	cellular tumor antigen P53	0.0446	0.1386	0.4992
Echinococcus multilocularis	tumor protein p63	0.3051	1	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0049	0.0072	0.0252
Trichomonas vaginalis	glucosylceramidase, putative	0.0351	0.107	0.6302
Plasmodium vivax	SWIB/MDM2 domain-containing protein, putative	0.0451	0.14	1
Loa Loa (eye worm)	jmjC domain-containing protein	0.0061	0.0111	0.0399
Trichomonas vaginalis	glucosylceramidase, putative	0.0535	0.1678	1
Loa Loa (eye worm)	SWIB/MDM2 domain-containing protein	0.0451	0.14	0.5045
Brugia malayi	isocitrate dehydrogenase	0.0033	0.0019	0.0064
Onchocerca volvulus	Huntingtin homolog	0.0258	0.0764	0.5449
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0033	0.0019	0.007
Schistosoma mansoni	hypothetical protein	0.0451	0.14	0.5042
Schistosoma mansoni	poly(ADP-ribose) glycohydrolase	0.0866	0.2775	1
Leishmania major	hypothetical protein, conserved	0.016	0.044	1
Brugia malayi	hypoxia-induced factor 1	0.015	0.0406	0.1458
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0061	0.0111	0.0393
Echinococcus granulosus	RUN	0.0042	0.0047	0.0045
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0049	0.0072	0.007
Loa Loa (eye worm)	hypothetical protein	0.0258	0.0764	0.2752
Onchocerca volvulus		0.016	0.044	0.3132
Trichomonas vaginalis	glucosylceramidase, putative	0.0351	0.107	0.6302
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0022	0.0078
Trichomonas vaginalis	glucosylceramidase, putative	0.0351	0.107	0.6302
Brugia malayi	hypothetical protein	0.0258	0.0764	0.2748
Toxoplasma gondii	NAC domain-containing protein	0.0038	0.0033	0.005
Echinococcus granulosus	Upstream activation factor subunit UAF30	0.0451	0.14	0.1399
Brugia malayi	PAS domain containing protein	0.0049	0.007	0.0246
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.0072	0.0252
Entamoeba histolytica	hypothetical protein	0.0386	0.1186	0.4205
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0033	0.0019	0.5
Echinococcus granulosus	transcription factor btf3	0.0038	0.0033	0.0032
Entamoeba histolytica	transcription factor BTF3, putative	0.0038	0.0033	0.0003
Toxoplasma gondii	Zn-finger in Ran binding protein and others domain-containing protein	0.016	0.044	0.1525
Plasmodium vivax	basic transcription factor 3b, putative	0.0038	0.0033	0.0101
Brugia malayi	latrophilin 2 splice variant baaae	0.0034	0.0022	0.0072
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0047	0.0169
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0033	0.0019	0.0018
Schistosoma mansoni	RNA binding protein	0.016	0.044	0.1579
Schistosoma mansoni	rab6-interacting	0.0042	0.0047	0.0163
Onchocerca volvulus		0.016	0.044	0.3132
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.0535	0.1678	0.6044
Schistosoma mansoni	aryl hydrocarbon receptor	0.0049	0.007	0.0246
Echinococcus granulosus	zinc finger protein Ran binding	0.016	0.044	0.0438
Trypanosoma cruzi	mitochondrial RNA binding complex 1 subunit, putative	0.016	0.044	0.1525
Schistosoma mansoni	hypothetical protein	0.0176	0.049	0.176
Loa Loa (eye worm)	hypothetical protein	0.0446	0.1386	0.4995
Echinococcus granulosus	polyADP ribose glycohydrolase	0.0866	0.2775	0.2774
Chlamydia trachomatis	SWIB complex protein	0.0451	0.14	0.5
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0037	0.0033	0.0031
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0061	0.0111	0.0109
Schistosoma mansoni	loxhd1	0.0042	0.0047	0.0163
Trichomonas vaginalis	glucosylceramidase, putative	0.0535	0.1678	1
Echinococcus granulosus	Zinc finger RanBP2 type	0.016	0.044	0.0438
Trypanosoma cruzi	poly(ADP-ribose) glycohydrolase, putative	0.0866	0.2775	1
Echinococcus granulosus	SWI:SNF matrix associated	0.0451	0.14	0.1399
Toxoplasma gondii	DNA topoisomerase domain-containing protein	0.0451	0.14	0.501
Onchocerca volvulus	Huntingtin homolog	0.0258	0.0764	0.5449
Trypanosoma cruzi	Zn-finger in Ran binding protein and others/FYVE zinc finger, putative	0.016	0.044	0.1525
Plasmodium falciparum	basic transcription factor 3b, putative	0.0038	0.0033	0.0101
Trypanosoma cruzi	hypothetical protein, conserved	0.016	0.044	0.1525
Schistosoma mansoni	hypothetical protein	0.0451	0.14	0.5042
Echinococcus granulosus	Polycystic kidney disease protein	0.0042	0.0047	0.0045
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.0072	0.0252
Trichomonas vaginalis	glucosylceramidase, putative	0.0351	0.107	0.6302
Schistosoma mansoni	hypothetical protein	0.0451	0.14	0.5042
Schistosoma mansoni	brg-1 associated factor	0.0451	0.14	0.5042
Leishmania major	hypothetical protein, conserved	0.016	0.044	1
Brugia malayi	brahma associated protein 60 kDa	0.0451	0.14	0.5042
Toxoplasma gondii	poly(ADP-ribose) glycohydrolase	0.0866	0.2775	1
Echinococcus granulosus	single minded 2	0.0036	0.0028	0.0026
Echinococcus granulosus	lipoxygenase domain containing protein	0.0042	0.0047	0.0045
Trypanosoma cruzi	poly(ADP-ribose) glycohydrolase, putative	0.0866	0.2775	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0351	0.107	0.6302
Trypanosoma brucei	poly(ADP-ribose) glycohydrolase, putative	0.0866	0.2775	1
Echinococcus multilocularis	poly(ADP ribose) glycohydrolase	0.0866	0.2775	0.2774
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0049	0.0072	0.0258
Plasmodium falciparum	zinc finger Ran-binding domain-containing protein 2, putative	0.016	0.044	0.3043
Onchocerca volvulus		0.0036	0.0028	0.0189
Entamoeba histolytica	poly(ADP-ribose) glycohydrolase, putative	0.0866	0.2775	1
Loa Loa (eye worm)	hypothetical protein	0.016	0.044	0.1584
Leishmania major	hypothetical protein, conserved	0.016	0.044	1
Schistosoma mansoni	TRABID protein (C64 family)	0.016	0.044	0.1579
Schistosoma mansoni	rab6-interacting	0.0042	0.0047	0.0163
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0033	0.0019	0.0064
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0535	0.1678	0.6047
Brugia malayi	bHLH-PAS transcription factor	0.0036	0.0028	0.0095
Onchocerca volvulus		0.0451	0.14	1
Leishmania major	hypothetical protein, conserved	0.016	0.044	1
Echinococcus multilocularis	Nuclear pore complex protein Nup153	0.016	0.044	0.0438
Trypanosoma cruzi	Zn-finger in Ran binding protein and others, putative	0.016	0.044	0.1525
Echinococcus multilocularis	SWI:SNF matrix associated	0.0451	0.14	0.1399
Trichomonas vaginalis	glucosylceramidase, putative	0.0535	0.1678	1
Trypanosoma cruzi	Zn-finger in Ran binding protein and others, putative	0.016	0.044	0.1525
Leishmania major	hypothetical protein, conserved	0.016	0.044	1
Loa Loa (eye worm)	Poly(ADP-ribose) glycohydrolase	0.0866	0.2775	1
Loa Loa (eye worm)	hypothetical protein	0.016	0.044	0.1584
Brugia malayi	beta-NAC-like protein	0.0038	0.0033	0.0114
Schistosoma mansoni	lipoxygenase	0.0174	0.0484	0.174
Schistosoma mansoni	polycystin 1-related	0.0042	0.0047	0.0163
Trichomonas vaginalis	glucosylceramidase, putative	0.0351	0.107	0.6302
Trypanosoma brucei	transcription factor BTF3, putative	0.0038	0.0033	0.005
Echinococcus multilocularis	transfer RNA-Lys	0.0036	0.0028	0.0026
Echinococcus multilocularis	lysine specific demethylase 5A	0.0061	0.0111	0.0109
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.016	0.044	0.1579
Onchocerca volvulus		0.0042	0.0047	0.0323
Brugia malayi	MH2 domain containing protein	0.0243	0.0712	0.2562
Trichomonas vaginalis	glucosylceramidase, putative	0.0351	0.107	0.6302
Loa Loa (eye worm)	hypothetical protein	0.005	0.0074	0.0266
Onchocerca volvulus		0.0042	0.0047	0.0323
Brugia malayi	hypothetical protein	0.0042	0.0047	0.0163
Schistosoma mansoni	transcription factor LCR-F1	0.0037	0.0033	0.0111
Entamoeba histolytica	hypothetical protein	0.0038	0.0033	0.0003
Echinococcus multilocularis	RUN	0.0042	0.0047	0.0045
Schistosoma mansoni	hypothetical protein	0.016	0.044	0.1579
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0049	0.0072	0.007
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.016	0.044	0.1579
Echinococcus granulosus	Nuclear pore complex protein Nup153	0.016	0.044	0.0438
Entamoeba histolytica	hypothetical protein	0.0866	0.2775	1
Echinococcus multilocularis	ring and YY1 binding protein	0.016	0.044	0.0438
Loa Loa (eye worm)	brahma associated protein	0.0451	0.14	0.5045
Loa Loa (eye worm)	hypothetical protein	0.016	0.044	0.1584
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0061	0.0111	0.0109
Onchocerca volvulus		0.016	0.044	0.3132
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.005	0.0074	0.0266
Echinococcus multilocularis	Polycystic kidney disease protein	0.0042	0.0047	0.0045
Schistosoma mansoni	hypothetical protein	0.0176	0.049	0.176
Plasmodium falciparum	SWIB/MDM2 domain-containing protein	0.0451	0.14	1
Loa Loa (eye worm)	cytochrome P450 family protein	0.0051	0.0076	0.0275
Schistosoma mansoni	hypothetical protein	0.0034	0.0022	0.0072
Trichomonas vaginalis	glucosylceramidase, putative	0.037	0.1132	0.6682
Echinococcus granulosus	ring and YY1 binding protein	0.016	0.044	0.0438
Trypanosoma cruzi	hypothetical protein, conserved	0.016	0.044	0.1525
Onchocerca volvulus		0.016	0.044	0.3132
Loa Loa (eye worm)	doublecortin family protein	0.0042	0.0047	0.0169
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0809	0.2586	0.2584
Toxoplasma gondii	ran binding protein	0.016	0.044	0.1525
Leishmania major	basic transcription factor 3a, putative	0.0038	0.0033	0.033
Echinococcus multilocularis	zinc finger protein Ran binding	0.016	0.044	0.0438
Chlamydia trachomatis	DNA topoisomerase I	0.0451	0.14	0.5
Plasmodium vivax	multidomain scavenger receptor, putative	0.0042	0.0047	0.0198
Brugia malayi	Poly	0.0866	0.2775	1
Mycobacterium ulcerans	putative regulatory protein	0.0036	0.0028	0.5
Trypanosoma brucei	mitochondrial RNA binding complex 1 subunit	0.016	0.044	0.1525
Brugia malayi	hypothetical protein	0.0037	0.0033	0.0111
Trypanosoma cruzi	hypothetical protein, conserved	0.016	0.044	0.1525
Trichomonas vaginalis	glucosylceramidase, putative	0.0535	0.1678	1
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0033	0.0019	0.0018
Schistosoma mansoni	jumonji domain containing protein	0.0061	0.0111	0.0393
Echinococcus granulosus	lipoxygenase domain containing protein	0.0042	0.0047	0.0045
Entamoeba histolytica	poly(ADP-ribose) glycohydrolase, putative	0.0386	0.1186	0.4205
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0028	0.0002	0.0006
Loa Loa (eye worm)	hypothetical protein	0.016	0.044	0.1584
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0061	0.0111	0.0393
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0033	0.0019	0.0018
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0033	0.0019	0.0018
Loa Loa (eye worm)	hypothetical protein	0.0163	0.0448	0.1614
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.005	0.0074	0.026
Echinococcus multilocularis	Upstream activation factor subunit UAF30	0.0451	0.14	0.1399
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0037	0.0033	0.0031
Trypanosoma cruzi	transcription factor btf3, putative	0.0038	0.0033	0.005
Onchocerca volvulus		0.0446	0.1386	0.9899
Trichomonas vaginalis	glucosylceramidase, putative	0.037	0.1132	0.6682
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0249	0.0732	0.073
Plasmodium vivax	hypothetical protein, conserved	0.0451	0.14	1
Loa Loa (eye worm)	ICD-1 protein	0.0038	0.0033	0.012
Schistosoma mansoni	lipoxygenase	0.0249	0.0732	0.2633
Brugia malayi	jmjC domain containing protein	0.0061	0.0111	0.0393
Brugia malayi	Calcitonin receptor-like protein seb-1	0.005	0.0074	0.026
Loa Loa (eye worm)	hypothetical protein	0.016	0.044	0.1584
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.0072	0.0252
Brugia malayi	YY1-associated factor 2	0.016	0.044	0.1579
Echinococcus granulosus	geminin	0.0176	0.049	0.0488
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.016	0.044	0.1579
Toxoplasma gondii	SWIB/MDM2 domain-containing protein	0.0451	0.14	0.501
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0049	0.0072	0.007
Plasmodium falciparum	LCCL domain-containing protein	0.0042	0.0047	0.0198
Echinococcus multilocularis	Zinc finger, RanBP2 type	0.016	0.044	0.0438
Echinococcus granulosus	lysine specific demethylase 5A	0.0061	0.0111	0.0109
Entamoeba histolytica	Acid sphingomyelinase-like phosphodiesterase, putative	0.0257	0.0758	0.2645
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.016	0.044	0.1579
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0047	0.0169
Brugia malayi	jmjC domain containing protein	0.0061	0.0111	0.0393
Loa Loa (eye worm)	MH2 domain-containing protein	0.0243	0.0712	0.2567
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0033	0.0019	0.0018
Onchocerca volvulus	Glucosylceramidase homolog	0.0351	0.107	0.7638
Brugia malayi	Cytochrome P450 family protein	0.0051	0.0076	0.0269
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0249	0.0732	0.073
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0042	0.0047	0.0045
Loa Loa (eye worm)	hypoxia-induced factor 1	0.015	0.0406	0.1464
Trichomonas vaginalis	glucosylceramidase, putative	0.0535	0.1678	1
Trypanosoma brucei	Zn-finger in Ran binding protein and others/FYVE zinc finger, putative	0.016	0.044	0.1525
Toxoplasma gondii	poly(ADP-ribose) glycohydrolase	0.0386	0.1186	0.4233
Trichomonas vaginalis	conserved hypothetical protein	0.0451	0.14	0.8311
Schistosoma mansoni	hypothetical protein	0.0042	0.0047	0.0163
Schistosoma mansoni	hypothetical protein	0.0037	0.0033	0.0111
Trypanosoma cruzi	WLM domain containing protein, putative	0.016	0.044	0.1525
Schistosoma mansoni	transcription factor btf3	0.0038	0.0033	0.0114

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.

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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 911805