TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 371.43 | Formula: C20H25N3O4
H donors: 2 H acceptors: 3 LogP: 2.82 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)N1CCC(CC1)/N=C/1\C(=C(\C1=N/c1cccc(c1)CC)O)O
InChi: 1S/C20H25N3O4/c1-3-13-6-5-7-15(12-13)22-17-16(18(24)19(17)25)21-14-8-10-23(11-9-14)20(26)27-4-2/h5-7,12,14,24-25H,3-4,8-11H2,1-2H3/b21-16-,22-17-
InChiKey: QRWUIECHDMPYQU-QLBLWQCWSA-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
Homo sapiens	neuropeptide S receptor 1	Starlite/ChEMBL	No references
Homo sapiens	ubiquitin specific peptidase 2	Starlite/ChEMBL	No references
Homo sapiens	arachidonate 15-lipoxygenase, type B	Starlite/ChEMBL	No references
Homo sapiens	SMAD family member 2	Starlite/ChEMBL	No references
Homo sapiens	microtubule-associated protein tau	Starlite/ChEMBL	No references
Homo sapiens	aldehyde dehydrogenase 1 family, member A1	Starlite/ChEMBL	No references
Homo sapiens	synuclein, alpha (non A4 component of amyloid precursor)	Starlite/ChEMBL	No references
Homo sapiens	lamin A/C	Starlite/ChEMBL	No references
Homo sapiens	muscleblind-like splicing regulator 1	Starlite/ChEMBL	No references
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Toxoplasma gondii	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma japonicum	ko:K00461 arachidonate 5-lipoxygenase [EC1.13.11.34], putative	Get druggable targets OG5_127482	All targets in OG5_127482
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	neuropeptide s receptor	Get druggable targets OG5_136011	All targets in OG5_136011
Echinococcus multilocularis	ubiquitin specific protease 41	Get druggable targets OG5_127431	All targets in OG5_127431
Leishmania infantum	ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative	Get druggable targets OG5_127431	All targets in OG5_127431
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Trypanosoma brucei gambiense	ubiquitin carboxyl-terminal hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative	Get druggable targets OG5_127431	All targets in OG5_127431
Echinococcus granulosus	lamin dm0	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	cytoplasmic intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	Aldehyde dehydrogenase, mitochondrial precursor, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132352	All targets in OG5_132352
Brugia malayi	Muscleblind-like protein	Get druggable targets OG5_132352	All targets in OG5_132352
Trypanosoma brucei	ubiquitin carboxyl-terminal hydrolase, putative	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma japonicum	IPR015063,Domain of unknown function DUF1873,domain-containing	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Neospora caninum	hypothetical protein	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	hypothetical protein	Get druggable targets OG5_127431	All targets in OG5_127431
Brugia malayi	Ubiquitin carboxyl-terminal hydrolase family protein	Get druggable targets OG5_127431	All targets in OG5_127431
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Trypanosoma congolense	ubiquitin carboxyl-terminal hydrolase, putative	Get druggable targets OG5_127431	All targets in OG5_127431
Leishmania donovani	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Brugia malayi	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	lipoxygenase	Get druggable targets OG5_127482	All targets in OG5_127482
Schistosoma japonicum	IPR001394,Peptidase C19, ubiquitin carboxyl-terminal hydrolase 2,domain-containing	Get druggable targets OG5_127431	All targets in OG5_127431
Echinococcus granulosus	muscleblind protein	Get druggable targets OG5_132352	All targets in OG5_132352
Schistosoma japonicum	Ubiquitin carboxyl-terminal hydrolase 8, putative	Get druggable targets OG5_127431	All targets in OG5_127431
Leishmania mexicana	ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma japonicum	ko:K04380 microtubule-associated protein tau, putative	Get druggable targets OG5_133504	All targets in OG5_133504
Entamoeba histolytica	ubiquitin carboxyl-terminal hydrolase domain containing protein	Get druggable targets OG5_127431	All targets in OG5_127431
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Cryptosporidium parvum	ubiquitin C-terminal hydrolase of the cysteine proteinase fold	Get druggable targets OG5_127431	All targets in OG5_127431
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	ko:K01072 ubiquitin thiolesterase [EC3.1.2.15], putative	Get druggable targets OG5_127431	All targets in OG5_127431
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	cytoplasmic intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	Lamin-C, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Giardia lamblia	Ubiquitin carboxyl-terminal hydrolase 4	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma mansoni	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus multilocularis	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	transcription factor SMAD2	Get druggable targets OG5_131716	All targets in OG5_131716
Trichomonas vaginalis	Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase	Get druggable targets OG5_127431	All targets in OG5_127431
Echinococcus granulosus	arachidonate 5 lipoxygenase	Get druggable targets OG5_127482	All targets in OG5_127482
Echinococcus granulosus	ubiquitin carboxyl terminal hydrolase 8	Get druggable targets OG5_127431	All targets in OG5_127431
Onchocerca volvulus		Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Leishmania major	ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma mansoni	microtubule-associated protein tau	Get druggable targets OG5_133504	All targets in OG5_133504
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Leishmania mexicana	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus granulosus	microtubule associated protein 2	Get druggable targets OG5_133504	All targets in OG5_133504
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus multilocularis	ubiquitin carboxyl terminal hydrolase 8	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma japonicum	expressed protein	Get druggable targets OG5_128723	All targets in OG5_128723
Onchocerca volvulus		Get druggable targets OG5_128723	All targets in OG5_128723
Leishmania donovani	ubiquitin carboxyl-terminal hydrolase, putative	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma mansoni	ubiquitin-specific peptidase 2 (C19 family)	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma mansoni	ubiquitin-specific peptidase 8 (C19 family)	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma japonicum	ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus multilocularis	lamin dm0	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	Peptidase C19, ubiquitin carboxyl terminal hydrolase 2	Get druggable targets OG5_127431	All targets in OG5_127431
Trypanosoma cruzi	ubiquitin carboxyl-terminal hydrolase, putative	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma japonicum	Retinal dehydrogenase 1, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	ubiquitin-specific protease	Get druggable targets OG5_127431	All targets in OG5_127431
Echinococcus granulosus	Peptidase C19 ubiquitin carboxyl terminal hydrolase 2	Get druggable targets OG5_127431	All targets in OG5_127431
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	muscleblind protein	Get druggable targets OG5_132352	All targets in OG5_132352
Echinococcus multilocularis	muscleblind protein 1	Get druggable targets OG5_132352	All targets in OG5_132352
Schistosoma mansoni	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Cryptosporidium hominis	ubiquitin specific protease 66	Get druggable targets OG5_127431	All targets in OG5_127431
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132352	All targets in OG5_132352
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	microtubule associated protein 2	Get druggable targets OG5_133504	All targets in OG5_133504
Brugia malayi	Intermediate filament tail domain containing protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	neuropeptide receptor A26	Get druggable targets OG5_136011	All targets in OG5_136011
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Trichomonas vaginalis	conserved hypothetical protein	Get druggable targets OG5_127431	All targets in OG5_127431
Schistosoma japonicum	expressed protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	arachidonate 5 lipoxygenase	Get druggable targets OG5_127482	All targets in OG5_127482
Schistosoma japonicum	Aldehyde dehydrogenase X, mitochondrial precursor, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	Mitochondrial aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus granulosus	ubiquitin specific protease 41	Get druggable targets OG5_127431	All targets in OG5_127431
Candida albicans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	Mitochondrial aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	Ubiquitin carboxyl-terminal hydrolase 8, putative	Get druggable targets OG5_127431	All targets in OG5_127431
Brugia malayi	MH2 domain containing protein	Get druggable targets OG5_131716	All targets in OG5_131716
Schistosoma mansoni	intermediate filament proteins	Get druggable targets OG5_128723	All targets in OG5_128723
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	expressed protein	Get druggable targets OG5_127431	All targets in OG5_127431
Trichomonas vaginalis	Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase	Get druggable targets OG5_127431	All targets in OG5_127431
Leishmania infantum	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Trypanosoma cruzi	ubiquitin carboxyl-terminal hydrolase, putative	Get druggable targets OG5_127431	All targets in OG5_127431
Echinococcus multilocularis	neuropeptide s receptor	Get druggable targets OG5_136011	All targets in OG5_136011
Schistosoma japonicum	ko:K07611 lamin, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	lipoxygenase	Get druggable targets OG5_127482	All targets in OG5_127482
Leishmania braziliensis	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	IPR001024,Lipoxygenase, LH2;IPR013819,Lipoxygenase, C-terminal,domain-containing	Get druggable targets OG5_127482	All targets in OG5_127482
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Loa Loa (eye worm)	MH2 domain-containing protein	Get druggable targets OG5_131716	All targets in OG5_131716
Schistosoma japonicum	IPR000276,Rhodopsin-like GPCR superfamily,domain-containing	Get druggable targets OG5_136011	All targets in OG5_136011
Echinococcus granulosus	neuropeptide receptor A26	Get druggable targets OG5_136011	All targets in OG5_136011
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	Intermediate filament protein ifa-1, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	musashi	Get druggable targets OG5_128723	All targets in OG5_128723
Leishmania braziliensis	ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative	Get druggable targets OG5_127431	All targets in OG5_127431

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %
Brugia malayi	MH2 domain containing protein	SMAD family member 2	467 aa	405 aa	31.6 %
Mycobacterium tuberculosis	Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1	aldehyde dehydrogenase 1 family, member A1	501 aa	456 aa	33.3 %
Plasmodium falciparum	ubiquitin specific protease, putative	ubiquitin specific peptidase 2	362 aa	378 aa	25.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Onchocerca volvulus		0.0024	0.007	0.007
Brugia malayi	Doublecortin family protein	0.0024	0.007	0.007
Echinococcus multilocularis	neuropeptide receptor A26	0.0558	0.5777	0.5777
Echinococcus multilocularis	muscleblind protein	0.018	0.1741	0.1741
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0339	0.3438	0.3438
Trypanosoma brucei	hypothetical protein, conserved	0.0339	0.3438	1
Trypanosoma cruzi	mitochondrial RNA binding complex 1 subunit, putative	0.0339	0.3438	1
Loa Loa (eye worm)	brahma associated protein	0.0954	1	1
Echinococcus granulosus	microtubule associated protein 2	0.0833	0.8712	0.8712
Schistosoma mansoni	lamin	0.0033	0.0163	0.0163
Plasmodium falciparum	LCCL domain-containing protein	0.0024	0.007	0.007
Leishmania major	ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative	0.0045	0.0292	0.085
Loa Loa (eye worm)	hypothetical protein	0.018	0.1741	0.1741
Schistosoma mansoni	zinc finger protein	0.0339	0.3438	0.3438
Schistosoma mansoni	intermediate filament proteins	0.0033	0.0163	0.0163
Echinococcus granulosus	Peptidase C19 ubiquitin carboxyl terminal hydrolase 2	0.0045	0.0292	0.0292
Loa Loa (eye worm)	hypothetical protein	0.0024	0.007	0.007
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0405	0.0405
Echinococcus multilocularis	Zinc finger, RanBP2 type	0.0339	0.3438	0.3438
Echinococcus granulosus	lipoxygenase domain containing protein	0.0024	0.007	0.007
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0073	0.0598	0.5
Echinococcus multilocularis	SWI:SNF matrix associated	0.0954	1	1
Toxoplasma gondii	SWIB/MDM2 domain-containing protein	0.0954	1	1
Loa Loa (eye worm)	intermediate filament protein	0.0033	0.0163	0.0163
Trypanosoma cruzi	mitochondrial RNA binding complex 1 subunit, putative	0.0339	0.3438	1
Schistosoma mansoni	rab6-interacting	0.0024	0.007	0.007
Onchocerca volvulus		0.0954	1	1
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0142	0.1336	0.1336
Echinococcus granulosus	ring and YY1 binding protein	0.0339	0.3438	0.3438
Echinococcus multilocularis	neuropeptide s receptor	0.0558	0.5777	0.5777
Echinococcus granulosus	muscleblind protein	0.018	0.1741	0.1741
Schistosoma mansoni	lamin	0.0033	0.0163	0.0163
Leishmania major	hypothetical protein, conserved	0.0339	0.3438	1
Schistosoma mansoni	hypothetical protein	0.0954	1	1
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0017	0.0002	0.0002
Onchocerca volvulus		0.0033	0.0163	0.0163
Echinococcus granulosus	zinc finger protein Ran binding	0.0339	0.3438	0.3438
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0024	0.007	0.007
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.0598	0.5
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0163	0.0163
Schistosoma mansoni	fusion	0.0339	0.3438	0.3438
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0073	0.0598	0.1741
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0405	0.0405
Trypanosoma brucei	ubiquitin carboxyl-terminal hydrolase, putative	0.0045	0.0292	0.085
Echinococcus granulosus	neuropeptide s receptor	0.0558	0.5777	0.5777
Brugia malayi	MH2 domain containing protein	0.0144	0.1355	0.1355
Toxoplasma gondii	Zn-finger in Ran binding protein and others domain-containing protein	0.0339	0.3438	0.3438
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0339	0.3438	0.3438
Echinococcus granulosus	Zinc finger RanBP2 type	0.0339	0.3438	0.3438
Loa Loa (eye worm)	hypothetical protein	0.0339	0.3438	0.3438
Trypanosoma cruzi	Zn-finger in Ran binding protein and others, putative	0.0339	0.3438	1
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0339	0.3438	0.3438
Trypanosoma brucei	hypothetical protein, conserved	0.0339	0.3438	1
Chlamydia trachomatis	SWIB complex protein	0.0954	1	0.5
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0073	0.0598	0.0598
Onchocerca volvulus		0.0339	0.3438	0.3438
Brugia malayi	Ubiquitin carboxyl-terminal hydrolase family protein	0.0045	0.0292	0.0292
Echinococcus granulosus	intermediate filament protein	0.0033	0.0163	0.0163
Echinococcus multilocularis	SWI:SNF matrix associated	0.0954	1	1
Onchocerca volvulus		0.0339	0.3438	0.3438
Leishmania major	hypothetical protein, conserved	0.0339	0.3438	1
Echinococcus multilocularis	RUN	0.0024	0.007	0.007
Schistosoma mansoni	RNA binding protein	0.0339	0.3438	0.3438
Plasmodium vivax	hypothetical protein, conserved	0.0954	1	1
Schistosoma mansoni	loxhd1	0.0024	0.007	0.007
Echinococcus granulosus	lamin	0.0033	0.0163	0.0163
Leishmania major	hypothetical protein, conserved	0.0339	0.3438	1
Echinococcus granulosus	neuropeptide receptor A26	0.0558	0.5777	0.5777
Echinococcus granulosus	Polycystic kidney disease protein	0.0024	0.007	0.007
Schistosoma mansoni	aldehyde dehydrogenase	0.0073	0.0598	0.0598
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0157	0.0157
Brugia malayi	YY1-associated factor 2	0.0339	0.3438	0.3438
Schistosoma mansoni	hypothetical protein	0.0024	0.007	0.007
Trichomonas vaginalis	conserved hypothetical protein	0.0954	1	1
Brugia malayi	intermediate filament protein	0.0033	0.0163	0.0163
Echinococcus multilocularis	Peptidase C19, ubiquitin carboxyl terminal hydrolase 2	0.0045	0.0292	0.0292
Schistosoma mansoni	brg-1 associated factor	0.0954	1	1
Loa Loa (eye worm)	hypothetical protein	0.0024	0.007	0.007
Loa Loa (eye worm)	hypothetical protein	0.0339	0.3438	0.3438
Schistosoma mansoni	polycystin 1-related	0.0024	0.007	0.007
Brugia malayi	cytoplasmic intermediate filament protein	0.0017	0.0002	0.0002
Trypanosoma cruzi	Zn-finger in Ran binding protein and others, putative	0.0339	0.3438	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0405	0.0405
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0339	0.3438	0.3438
Schistosoma mansoni	lipoxygenase	0.01	0.0879	0.0879
Echinococcus multilocularis	Polycystic kidney disease protein	0.0024	0.007	0.007
Plasmodium vivax	SWIB/MDM2 domain-containing protein, putative	0.0954	1	1
Schistosoma mansoni	hypothetical protein	0.0339	0.3438	0.3438
Trypanosoma brucei	mitochondrial RNA binding complex 1 subunit	0.0339	0.3438	1
Trichomonas vaginalis	Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase	0.0045	0.0292	0.0292
Loa Loa (eye worm)	transcription factor SMAD2	0.0144	0.1355	0.1355
Leishmania major	hypothetical protein, conserved	0.0339	0.3438	1
Trichomonas vaginalis	conserved hypothetical protein	0.0045	0.0292	0.0292
Loa Loa (eye worm)	hypothetical protein	0.0339	0.3438	0.3438
Loa Loa (eye worm)	doublecortin family protein	0.0024	0.007	0.007
Trypanosoma brucei	Zn-finger in Ran binding protein and others/FYVE zinc finger, putative	0.0339	0.3438	1
Entamoeba histolytica	ubiquitin carboxyl-terminal hydrolase domain containing protein	0.0045	0.0292	1
Echinococcus multilocularis	ring finger protein 113a	0.0017	0.0001	0.0001
Schistosoma mansoni	hypothetical protein	0.0954	1	1
Plasmodium falciparum	SWIB/MDM2 domain-containing protein	0.0954	1	1
Echinococcus multilocularis	lamin dm0	0.0033	0.0163	0.0163
Loa Loa (eye worm)	RiNg Finger protein family member	0.0017	0.0001	0.0001
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0073	0.0598	0.0598
Echinococcus granulosus	ring finger protein 113a	0.0017	0.0001	0.0001
Giardia lamblia	Ubiquitin carboxyl-terminal hydrolase 4	0.0045	0.0292	1
Trypanosoma cruzi	ubiquitin carboxyl-terminal hydrolase, putative	0.0045	0.0292	0.085
Echinococcus granulosus	SWI:SNF matrix associated	0.0954	1	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.0598	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0339	0.3438	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0405	0.0405
Schistosoma mansoni	lipoxygenase	0.0142	0.1336	0.1336
Echinococcus granulosus	lipoxygenase domain containing protein	0.0024	0.007	0.007
Echinococcus multilocularis	muscleblind protein 1	0.018	0.1741	0.1741
Schistosoma mansoni	rab6-interacting	0.0024	0.007	0.007
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.0405	0.0405
Echinococcus multilocularis	Upstream activation factor subunit UAF30	0.0954	1	1
Trichomonas vaginalis	cell cycle control protein cwf24, putative	0.0017	0.0001	0.0001
Schistosoma mansoni	hypothetical protein	0.0017	0.0001	0.0001
Leishmania major	hypothetical protein, conserved	0.0339	0.3438	1
Trypanosoma cruzi	Zn-finger in Ran binding protein and others/FYVE zinc finger, putative	0.0339	0.3438	1
Brugia malayi	hypothetical protein	0.0024	0.007	0.007
Echinococcus multilocularis	ring and YY1 binding protein	0.0339	0.3438	0.3438
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.0405	0.0405
Echinococcus multilocularis	zinc finger protein Ran binding	0.0339	0.3438	0.3438
Echinococcus multilocularis	SWI:SNF matrix associated	0.0954	1	1
Toxoplasma gondii	aldehyde dehydrogenase	0.0073	0.0598	0.0598
Echinococcus granulosus	Upstream activation factor subunit UAF30	0.0954	1	1
Brugia malayi	SWIB/MDM2 domain containing protein	0.0954	1	1
Echinococcus multilocularis	ubiquitin specific protease 41	0.0045	0.0292	0.0292
Brugia malayi	hypothetical protein	0.0024	0.007	0.007
Trypanosoma cruzi	hypothetical protein, conserved	0.0339	0.3438	1
Brugia malayi	Zinc finger protein 183 homolog	0.0017	0.0001	0.0001
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0405	0.0405
Trypanosoma cruzi	WLM domain containing protein, putative	0.0339	0.3438	1
Schistosoma mansoni	ubiquitin-specific peptidase 2 (C19 family)	0.0045	0.0292	0.0292
Brugia malayi	Intermediate filament tail domain containing protein	0.0033	0.0163	0.0163
Schistosoma mansoni	ubiquitin-specific peptidase 8 (C19 family)	0.0045	0.0292	0.0292
Onchocerca volvulus		0.0339	0.3438	0.3438
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0033	0.0163	0.0163
Echinococcus multilocularis	Nuclear pore complex protein Nup153	0.0339	0.3438	0.3438
Onchocerca volvulus	Ubiquitin thioesterase ZRANB1 homolog	0.0339	0.3438	0.3438
Loa Loa (eye worm)	hypothetical protein	0.0339	0.3438	0.3438
Onchocerca volvulus		0.0033	0.0163	0.0163
Plasmodium falciparum	SWIB/MDM2 domain-containing protein	0.0954	1	1
Schistosoma mansoni	TRABID protein (C64 family)	0.0339	0.3438	0.3438
Echinococcus multilocularis	ubiquitin carboxyl terminal hydrolase 8	0.0045	0.0292	0.0292
Schistosoma mansoni	microtubule-associated protein tau	0.0833	0.8712	0.8712
Echinococcus multilocularis	microtubule associated protein 2	0.0833	0.8712	0.8712
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0405	0.0405
Loa Loa (eye worm)	hypothetical protein	0.0339	0.3438	0.3438
Onchocerca volvulus		0.0339	0.3438	0.3438
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0142	0.1336	0.1336
Loa Loa (eye worm)	hypothetical protein	0.018	0.1741	0.1741
Loa Loa (eye worm)	SWIB/MDM2 domain-containing protein	0.0954	1	1
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0292	0.0292
Toxoplasma gondii	ran binding protein	0.0339	0.3438	0.3438
Schistosoma mansoni	hypothetical protein	0.0954	1	1
Toxoplasma gondii	DNA topoisomerase domain-containing protein	0.0954	1	1
Schistosoma mansoni	aldehyde dehydrogenase	0.0073	0.0598	0.0598
Echinococcus granulosus	Nuclear pore complex protein Nup153	0.0339	0.3438	0.3438
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.0598	0.5
Brugia malayi	Muscleblind-like protein	0.018	0.1741	0.1741
Echinococcus multilocularis	musashi	0.0033	0.0163	0.0163
Chlamydia trachomatis	DNA topoisomerase I	0.0954	1	0.5
Trypanosoma cruzi	WLM domain containing protein, putative	0.0339	0.3438	1
Brugia malayi	brahma associated protein 60 kDa	0.0954	1	1
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0024	0.007	0.007
Loa Loa (eye worm)	MH2 domain-containing protein	0.0144	0.1355	0.1355
Echinococcus granulosus	RUN	0.0024	0.007	0.007
Plasmodium falciparum	zinc finger Ran-binding domain-containing protein 2, putative	0.0339	0.3438	0.3438
Trypanosoma cruzi	ubiquitin carboxyl-terminal hydrolase, putative	0.0045	0.0292	0.085
Echinococcus granulosus	ubiquitin carboxyl terminal hydrolase 8	0.0045	0.0292	0.0292
Echinococcus granulosus	lamin dm0	0.0033	0.0163	0.0163
Plasmodium vivax	multidomain scavenger receptor, putative	0.0024	0.007	0.007
Echinococcus multilocularis	lamin	0.0033	0.0163	0.0163
Trichomonas vaginalis	Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase	0.0045	0.0292	0.0292
Trypanosoma cruzi	hypothetical protein, conserved	0.0339	0.3438	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0405	0.0405
Onchocerca volvulus		0.0024	0.007	0.007
Echinococcus granulosus	ubiquitin specific protease 41	0.0045	0.0292	0.0292

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.0029 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	= 1.2589 um	PUBCHEM_BIOASSAY: qHTS Assay for Antagonists of the Neuropeptide S Receptor: cAMP Signal Transduction. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	6.3096 uM	PubChem BioAssay. qHTS of alpha-syn Inhibitors. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	6.3096 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860]	ChEMBL.	No reference
Potency (functional)	= 7.0795 um	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. (Class of assay: confirmatory) [Related pubchem assays: 596 ]	ChEMBL.	No reference
Potency (functional)	= 10 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Ubiquitin-specific Protease USP2a. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	10.4179 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	11.2202 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	12.5893 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of 15-hLO-2 (15-human lipoxygenase 2). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2312, AID2537, AID2702]	ChEMBL.	No reference
Potency (functional)	= 14.1254 um	PUBCHEM_BIOASSAY: Counterscreen qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. This assay monitors tau fibrillation by fluorescence polarization (FP) of Alexa 594-labeled K18 P301L, which does not fibrillize readily but incorporates into growing filaments of unlabeled tau. (Class of assay: confirmatory) [Related pubchem assays: 596 ]	ChEMBL.	No reference
Potency (functional)	= 14.1254 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))]	ChEMBL.	No reference
Potency (binding)	14.1254 uM	PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 15.8489 um	PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	15.8489 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860]	ChEMBL.	No reference
Potency (functional)	= 22.3872 um	PUBCHEM_BIOASSAY: qHTS Multiplex Assay to Identify Dual Action Probes in a Cell Model of Huntington: Aggregate Formation (GFP). (Class of assay: confirmatory) [Related pubchem assays: 1482, 1471 ]	ChEMBL.	No reference
Potency (functional)	25.929 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125]	ChEMBL.	No reference
Potency (functional)	= 28.1838 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 28.1838 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))]	ChEMBL.	No reference
Potency (binding)	= 31.6228 um	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ]	ChEMBL.	No reference
Potency (binding)	= 31.6228 um	PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)]	ChEMBL.	No reference
Potency (functional)	31.6228 uM	PubChem BioAssay. qHTS for Antagonists of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	79.4328 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23
Homo sapiens	ChEMBL23

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: CHEMBL1990804

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1608592