TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 439.547 | Formula: C25H33N3O4
H donors: 3 H acceptors: 4 LogP: 3.47 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: O=C(c1ccc(cc1)C(=O)O)N1CCC(CC1)CNC(=O)NC12CC3CC(C2)CC(C1)C3
InChi: 1S/C25H33N3O4/c29-22(20-1-3-21(4-2-20)23(30)31)28-7-5-16(6-8-28)15-26-24(32)27-25-12-17-9-18(13-25)11-19(10-17)14-25/h1-4,16-19H,5-15H2,(H,30,31)(H2,26,27,32)
InChiKey: CQIDMTXTVVPATC-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

Species	Target name	Source	Bibliographic reference
Homo sapiens	epoxide hydrolase 1, microsomal (xenobiotic)	Starlite/ChEMBL	No references
Homo sapiens	epoxide hydrolase 2, cytoplasmic	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Mycobacterium tuberculosis	Probable epoxide hydrolase EphA (epoxide hydratase) (arene-oxide hydratase)	Get druggable targets OG5_129061	All targets in OG5_129061
Brugia malayi	hydrolase, alpha/beta fold family protein	Get druggable targets OG5_130194	All targets in OG5_130194
Onchocerca volvulus	Epoxide hydrolase 1 homolog	Get druggable targets OG5_130194	All targets in OG5_130194
Loa Loa (eye worm)	hydrolase	Get druggable targets OG5_130194	All targets in OG5_130194
Mycobacterium ulcerans	epoxide hydrolase EphA	Get druggable targets OG5_129061	All targets in OG5_129061

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	alpha tubulin	0.0183	0.2638	0.8612
Trypanosoma cruzi	p450 reductase, putative	0.0074	0.0783	0.2559
Loa Loa (eye worm)	BEN-1 protein	0.0208	0.306	0.3089
Trypanosoma brucei	NADPH--cytochrome P450 reductase, putative	0.0074	0.0783	0.2559
Trichomonas vaginalis	tubulin gamma chain, putative	0.0123	0.1619	0.5291
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1353	0.1366
Schistosoma mansoni	alpha tubulin	0.0183	0.2638	0.8612
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0029	0.0013	0.0028
Loa Loa (eye worm)	BEN-1 protein	0.0208	0.306	0.3089
Brugia malayi	alpha-tubulin	0.0183	0.2638	0.5534
Brugia malayi	tubulin alpha-2 chain	0.0183	0.2638	0.5534
Trypanosoma brucei	beta tubulin	0.0208	0.306	1
Loa Loa (eye worm)	tubulin beta chain	0.0054	0.0429	0.0433
Toxoplasma gondii	beta tubulin	0.0208	0.306	1
Echinococcus multilocularis	tubulin alpha 3 chain	0.0183	0.2638	0.8612
Echinococcus multilocularis	tubulin alpha 3 chain	0.0183	0.2638	0.8612
Echinococcus granulosus	peroxisome assembly protein 26	0.0183	0.2638	0.8612
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0033	0.0078	0.0212
Onchocerca volvulus		0.0192	0.2794	0.2784
Schistosoma mansoni	tubulin subunit alpha	0.0183	0.2638	0.8612
Loa Loa (eye worm)	tubulin beta-2A chain	0.0208	0.306	0.3089
Trichomonas vaginalis	tubulin alpha chain, putative	0.0208	0.306	1
Echinococcus granulosus	tubulin gamma 1 chain	0.0123	0.1619	0.527
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Leishmania major	beta tubulin	0.0208	0.306	1
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.0043	0.0243	0.051
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0033	0.0078	0.0212
Trypanosoma brucei	alpha tubulin	0.0183	0.2638	0.8618
Trypanosoma brucei	beta tubulin	0.0208	0.306	1
Leishmania major	beta tubulin	0.0208	0.306	1
Echinococcus multilocularis	tubulin gamma 1 chain	0.0123	0.1619	0.527
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0183	0.2638	0.2662
Mycobacterium ulcerans	cell division protein FtsZ	0.0054	0.0429	0.1446
Giardia lamblia	Hypothetical protein	0.0066	0.0639	0.08
Brugia malayi	Muscleblind-like protein	0.0108	0.1353	0.284
Brugia malayi	Tubulin alpha-2 chain	0.0183	0.2638	0.5534
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0183	0.2638	0.8612
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.007	0.0706	0.2305
Trypanosoma brucei	hypothetical protein, conserved	0.0029	0.0013	0.0043
Leishmania major	NADPH-cytochrome p450 reductase-like protein	0.0074	0.0783	0.2559
Schistosoma mansoni	tubulin subunit beta	0.0208	0.306	1
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0054	0.0429	0.1363
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0183	0.2638	0.8612
Echinococcus multilocularis	tubulin beta 1 chain	0.0208	0.306	1
Loa Loa (eye worm)	beta-lactamase	0.0029	0.0013	0.0013
Echinococcus granulosus	tubulin alpha 1C chain	0.0183	0.2638	0.8612
Trichomonas vaginalis	tubulin alpha chain, putative	0.007	0.0706	0.2305
Loa Loa (eye worm)	tubulin beta-4 chain	0.0208	0.306	0.3089
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.2638	0.8618
Trypanosoma brucei	beta tubulin	0.0208	0.306	1
Loa Loa (eye worm)	tubulin alpha chain	0.0183	0.2638	0.2662
Trichomonas vaginalis	tubulin beta chain, putative	0.007	0.0706	0.2305
Trypanosoma brucei	zeta tubulin	0.0054	0.0429	0.14
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0043	0.0243	0.08
Loa Loa (eye worm)	alpha-tubulin	0.0183	0.2638	0.2662
Echinococcus granulosus	Tubulin beta 2C chain	0.0208	0.306	1
Brugia malayi	hypothetical protein	0.0192	0.2788	0.5849
Mycobacterium ulcerans	epoxide hydrolase EphA	0.0197	0.2885	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.2638	0.8618
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0183	0.2638	0.8618
Schistosoma mansoni	alpha-glucosidase	0.0104	0.1295	0.4205
Schistosoma mansoni	5-methyl tetrahydrofolate-homocysteine methyltransferase reductase	0.0046	0.0298	0.0935
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0054	0.0429	0.1363
Brugia malayi	Pre-SET motif family protein	0.0169	0.2396	0.5026
Echinococcus multilocularis	tubulin alpha chain	0.0183	0.2638	0.8612
Brugia malayi	Cell division protein ftsZ	0.0054	0.0429	0.0899
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.2638	0.8618
Schistosoma mansoni	hypothetical protein	0.0039	0.0182	0.0555
Echinococcus granulosus	tubulin subunit beta	0.0208	0.306	1
Leishmania major	zeta tubulin, putative	0.0054	0.0429	0.14
Brugia malayi	beta-lactamase	0.0029	0.0013	0.0028
Echinococcus granulosus	tubulin alpha chain	0.0183	0.2638	0.8612
Trypanosoma brucei	NADPH--cytochrome P450 reductase, putative	0.0074	0.0783	0.2559
Giardia lamblia	Gamma tubulin	0.0123	0.1619	0.4524
Giardia lamblia	Beta tubulin	0.0208	0.306	1
Echinococcus multilocularis	tubulin alpha chain	0.0183	0.2638	0.8612
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0013	0.0013
Schistosoma mansoni	NADPH flavin oxidoreductase	0.0037	0.0154	0.0461
Trypanosoma cruzi	NADPH-dependent FMN/FAD containing oxidoreductase, putative	0.0074	0.0783	0.2559
Echinococcus granulosus	Tubulin alpha 1 chain	0.0183	0.2638	0.8612
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Brugia malayi	tubulin alpha chain - mouse	0.0183	0.2638	0.5534
Onchocerca volvulus		0.0039	0.0182	0.0169
Loa Loa (eye worm)	alpha-tubulin	0.0183	0.2638	0.2662
Trypanosoma cruzi	epsilon tubulin, putative	0.0123	0.1619	0.5291
Toxoplasma gondii	beta-tubulin, putative	0.0208	0.306	1
Brugia malayi	Tubulin beta-1 chain	0.0208	0.306	0.6421
Schistosoma mansoni	tubulin subunit epsilon	0.0123	0.1619	0.527
Echinococcus multilocularis	beta tubulin	0.0208	0.306	1
Echinococcus multilocularis	methionine synthase reductase	0.0046	0.0298	0.0935
Trypanosoma brucei	epsilon tubulin	0.0123	0.1619	0.5291
Plasmodium vivax	tubulin beta chain, putative	0.0208	0.306	1
Plasmodium vivax	flavodoxin domain containing protein	0.0066	0.0639	0.2088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0033	0.0078	0.0212
Echinococcus granulosus	muscleblind protein	0.0108	0.1353	0.4398
Leishmania major	beta tubulin	0.0208	0.306	1
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0043	0.0243	0.0754
Echinococcus multilocularis	tubulin delta chain	0.0054	0.0429	0.1363
Mycobacterium tuberculosis	Probable epoxide hydrolase EphA (epoxide hydratase) (arene-oxide hydratase)	0.0197	0.2885	1
Loa Loa (eye worm)	hypothetical protein	0.0183	0.2638	0.2662
Schistosoma mansoni	survival motor neuron protein	0.0039	0.0182	0.0555
Giardia lamblia	Beta tubulin	0.0208	0.306	1
Entamoeba histolytica	tubulin alpha-1 chain	0.0183	0.2638	0.8618
Brugia malayi	flavodoxin family protein	0.0074	0.0783	0.1643
Trichomonas vaginalis	tubulin, putative	0.0208	0.306	1
Trypanosoma brucei	tubulin gamma chain	0.0123	0.1619	0.5291
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0013	0.0013
Trichomonas vaginalis	conserved hypothetical protein	0.0054	0.0429	0.14
Giardia lamblia	Beta tubulin	0.0208	0.306	1
Schistosoma mansoni	alpha tubulin	0.0183	0.2638	0.8612
Echinococcus granulosus	Tubulin beta 2C chain	0.0208	0.306	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0208	0.306	1
Giardia lamblia	Alpha-tubulin	0.0183	0.2638	0.8393
Trichomonas vaginalis	D-aminoacylase, putative	0.0029	0.0013	0.0043
Trichomonas vaginalis	set domain proteins, putative	0.0192	0.2794	0.9128
Echinococcus multilocularis	tubulin alpha chain	0.0183	0.2638	0.8612
Trichomonas vaginalis	tubulin alpha chain, putative	0.007	0.0706	0.2305
Leishmania major	beta tubulin	0.0208	0.306	1
Entamoeba histolytica	tubulin alpha chain, putative	0.0183	0.2638	0.8618
Toxoplasma gondii	alpha-tubulin I, putative	0.0183	0.2638	0.8612
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0039	0.0182	0.0383
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0033	0.0078	0.0212
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.2638	0.8618
Leishmania major	gamma-tubulin	0.0123	0.1619	0.5291
Schistosoma mansoni	diflavin oxidoreductase	0.0037	0.0144	0.043
Echinococcus granulosus	Tubulin beta 2C chain	0.0208	0.306	1
Leishmania major	beta tubulin	0.0208	0.306	1
Echinococcus granulosus	alpha tubulin	0.0183	0.2638	0.8612
Echinococcus granulosus	beta tubulin	0.0208	0.306	1
Trypanosoma brucei	alpha tubulin	0.0183	0.2638	0.8618
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0183	0.2638	0.8618
Plasmodium vivax	NADPH-cytochrome p450 reductase, putative	0.0074	0.0783	0.2559
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.2638	0.8618
Leishmania major	beta tubulin	0.0208	0.306	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0033	0.0078	0.0212
Echinococcus granulosus	tubulin alpha 3 chain	0.0183	0.2638	0.8612
Trypanosoma cruzi	cytochrome P450 reductase, putative	0.0074	0.0783	0.2559
Brugia malayi	Tubulin beta chain	0.007	0.0706	0.148
Echinococcus granulosus	Tubulin beta 2C chain	0.0208	0.306	1
Brugia malayi	hydrolase, alpha/beta fold family protein	0.0308	0.4767	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0033	0.0078	0.0079
Loa Loa (eye worm)	hypothetical protein	0.0113	0.1447	0.146
Trypanosoma cruzi	tubulin delta chain	0.0054	0.0429	0.14
Plasmodium vivax	tubulin gamma chain, putative	0.0123	0.1619	0.5291
Echinococcus granulosus	tubulin subunit TubB	0.0183	0.2638	0.8612
Plasmodium falciparum	tubulin delta chain, putative	0.0054	0.0429	0.14
Brugia malayi	Tubulin alpha chain	0.0183	0.2638	0.5534
Echinococcus granulosus	tubulin beta 1 chain	0.0208	0.306	1
Giardia lamblia	Nitric oxide synthase, inducible	0.0066	0.0639	0.08
Echinococcus granulosus	lysosomal alpha glucosidase	0.0121	0.1583	0.515
Schistosoma mansoni	tubulin subunit alpha	0.0183	0.2638	0.8612
Leishmania major	delta tubulin, putative	0.0054	0.0429	0.14
Trypanosoma cruzi	zeta tubulin, putative	0.0054	0.0429	0.14
Leishmania major	beta tubulin	0.0208	0.306	1
Trypanosoma brucei	beta tubulin	0.0123	0.1619	0.5291
Mycobacterium ulcerans	formate dehydrogenase H FdhF	0.0074	0.0783	0.2682
Loa Loa (eye worm)	FAD binding domain-containing protein	0.0074	0.0783	0.0791
Echinococcus granulosus	Tubulin beta 2C chain	0.0208	0.306	1
Schistosoma mansoni	tubulin subunit alpha	0.0183	0.2638	0.8612
Echinococcus multilocularis	muscleblind protein 1	0.0108	0.1353	0.4398
Leishmania major	beta tubulin	0.0208	0.306	1
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0121	0.1583	0.1597
Echinococcus multilocularis	muscleblind protein	0.0108	0.1353	0.4398
Plasmodium vivax	hypothetical protein, conserved	0.0029	0.0013	0.0043
Echinococcus granulosus	tubulin alpha 3 chain	0.0183	0.2638	0.8612
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.004	0.0194	0.0196
Leishmania major	beta tubulin	0.0208	0.306	1
Brugia malayi	beta-lactamase family protein	0.0029	0.0013	0.0028
Trichomonas vaginalis	D-aminoacylase, putative	0.0029	0.0013	0.0043
Trichomonas vaginalis	tubulin alpha chain, putative	0.007	0.0706	0.2305
Schistosoma mansoni	alpha-glucosidase	0.0104	0.1295	0.4205
Echinococcus multilocularis	tubulin epsilon chain	0.0123	0.1619	0.527
Trichomonas vaginalis	tubulin gamma chain, putative	0.0054	0.0429	0.14
Trypanosoma brucei	NADPH-dependent diflavin oxidoreductase 1	0.0074	0.0783	0.2559
Trichomonas vaginalis	sulfite reductase, putative	0.0074	0.0783	0.2559
Schistosoma mansoni	tubulin subunit beta	0.0208	0.306	1
Trichomonas vaginalis	penicillin-binding protein, putative	0.0029	0.0013	0.0043
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0123	0.1619	0.527
Echinococcus granulosus	tubulin alpha chain	0.0183	0.2638	0.8612
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0043	0.0243	0.0754
Echinococcus granulosus	NADPH cytochrome P450 reductase	0.0074	0.0783	0.2527
Trypanosoma brucei	beta tubulin	0.0208	0.306	1
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0183	0.2638	0.8612
Echinococcus multilocularis	tubulin subunit beta	0.0208	0.306	1
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0121	0.1583	0.515
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Trichomonas vaginalis	tubulin gamma chain, putative	0.0123	0.1619	0.5291
Echinococcus multilocularis	survival motor neuron protein 1	0.0192	0.2788	0.9106
Treponema pallidum	cell division protein FtsZ	0.0054	0.0429	1
Toxoplasma gondii	beta-1 tubulin, putative	0.0208	0.306	1
Trichomonas vaginalis	penicillin-binding protein, putative	0.0029	0.0013	0.0043
Leishmania major	beta tubulin	0.0208	0.306	1
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0183	0.2638	0.8618
Trypanosoma brucei	alpha tubulin	0.0183	0.2638	0.8618
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0033	0.0078	0.0163
Echinococcus multilocularis	Tubulin beta 2C chain	0.0208	0.306	1
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0121	0.1583	0.332
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0033	0.0078	0.0212
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Trypanosoma brucei	zeta tubulin, putative	0.0054	0.0429	0.14
Loa Loa (eye worm)	tubulin alpha-3 chain	0.0113	0.1447	0.146
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0208	0.306	1
Schistosoma mansoni	tubulin subunit beta	0.0054	0.0429	0.1363
Trichomonas vaginalis	tubulin, putative	0.007	0.0706	0.2305
Schistosoma mansoni	tubulin subunit beta	0.0208	0.306	1
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Trichomonas vaginalis	tubulin gamma chain, putative	0.0208	0.306	1
Loa Loa (eye worm)	tubulin alpha 2	0.006	0.0533	0.0538
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Plasmodium falciparum	tubulin gamma chain	0.0123	0.1619	0.5291
Trichomonas vaginalis	D-aminoacylase, putative	0.0029	0.0013	0.0043
Toxoplasma gondii	alpha tubulin TUBA1	0.0183	0.2638	0.8612
Trypanosoma brucei	NADPH-cytochrome p450 reductase, putative	0.0074	0.0783	0.2559
Leishmania major	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.0043	0.0243	0.0794
Trypanosoma cruzi	hypothetical protein, conserved	0.0029	0.0013	0.0043
Echinococcus granulosus	Tubulin alpha 1 chain	0.0183	0.2638	0.8612
Trypanosoma brucei	epsilon tubulin	0.0123	0.1619	0.5291
Trichomonas vaginalis	tubulin alpha chain, putative	0.0123	0.1619	0.5291
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0013	0.0013
Leishmania major	beta tubulin	0.0208	0.306	1
Trypanosoma cruzi	cytochrome P450 reductase, putative	0.0074	0.0783	0.2559
Trichomonas vaginalis	esterase, putative	0.0029	0.0013	0.0043
Leishmania major	p450 reductase, putative	0.0074	0.0783	0.2559
Loa Loa (eye worm)	tubulin alpha chain	0.0183	0.2638	0.2662
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0129	0.1724	0.5633
Echinococcus multilocularis	peroxisome assembly protein 26	0.0183	0.2638	0.8612
Schistosoma mansoni	tubulin subunit delta	0.0054	0.0429	0.1363
Onchocerca volvulus		0.007	0.0706	0.0693
Echinococcus granulosus	tubulin delta chain	0.0054	0.0429	0.1363
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1353	0.1366
Echinococcus multilocularis	tubulin alpha 1C chain	0.0183	0.2638	0.8612
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0187	0.2699	0.9354
Trypanosoma cruzi	zeta tubulin, putative	0.0054	0.0429	0.14
Trypanosoma brucei	alpha tubulin	0.0183	0.2638	0.8618
Echinococcus multilocularis	tubulin subunit TubB	0.0183	0.2638	0.8612
Loa Loa (eye worm)	tubulin beta chain	0.0208	0.306	0.3089
Trypanosoma cruzi	alpha tubulin, putative	0.0183	0.2638	0.8618
Loa Loa (eye worm)	hydrolase	0.0609	0.9907	1
Loa Loa (eye worm)	beta-tubulin	0.0208	0.306	0.3089
Loa Loa (eye worm)	hypothetical protein	0.0129	0.1724	0.174
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0208	0.306	1
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0013	0.0013
Loa Loa (eye worm)	tubulin alpha 2	0.0129	0.1724	0.174
Echinococcus granulosus	tubulin epsilon chain	0.0123	0.1619	0.527
Brugia malayi	FAD binding domain containing protein	0.0046	0.0298	0.0625
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0013	0.0013
Trypanosoma brucei	epsilon tubulin	0.0123	0.1619	0.5291
Echinococcus granulosus	beta tubulin	0.0208	0.306	1
Plasmodium vivax	delta tubulin, putative	0.0054	0.0429	0.14
Echinococcus multilocularis	tubulin alpha	0.0123	0.1619	0.527
Mycobacterium leprae	cell division protein FtsZ	0.0054	0.0429	1
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0208	0.306	1
Leishmania major	hypothetical protein, conserved	0.0029	0.0013	0.0043
Brugia malayi	Tubulin alpha-2 chain	0.0183	0.2638	0.5534
Echinococcus multilocularis	tubulin alpha 1C chain	0.0183	0.2638	0.8612
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0013	0.0013
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0121	0.1583	0.515
Leishmania major	beta tubulin	0.0208	0.306	1
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0043	0.0243	0.08
Trichomonas vaginalis	tubulin beta chain, putative	0.0208	0.306	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0033	0.0078	0.0212
Trichomonas vaginalis	tubulin beta-1 chain, putative	0.0054	0.0429	0.14
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0029	0.0013	0.0013
Toxoplasma gondii	flavodoxin domain-containing protein	0.0037	0.0144	0.043
Echinococcus granulosus	NADPH dependent diflavin oxidoreductase 1	0.0074	0.0783	0.2527
Loa Loa (eye worm)	hypothetical protein	0.0192	0.2788	0.2814
Leishmania major	beta tubulin	0.0208	0.306	1
Trypanosoma cruzi	beta tubulin, putative	0.0208	0.306	1
Echinococcus granulosus	tubulin alpha 1C chain	0.0183	0.2638	0.8612
Chlamydia trachomatis	sulfite reductase	0.0046	0.0298	0.5
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.0043	0.0243	0.0754
Schistosoma mansoni	tubulin subunit beta	0.0208	0.306	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0183	0.2638	0.8618
Wolbachia endosymbiont of Brugia malayi	cell division protein FtsZ	0.0054	0.0429	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0029	0.0013	0.0043
Entamoeba histolytica	tubulin family protein	0.0208	0.306	1
Echinococcus granulosus	methionine synthase reductase	0.0046	0.0298	0.0935
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0113	0.1447	0.4728
Leishmania major	beta tubulin	0.0208	0.306	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0208	0.306	1
Echinococcus granulosus	tubulin alpha	0.0123	0.1619	0.527
Leishmania major	beta tubulin	0.0208	0.306	1
Leishmania major	cytochrome P450 reductase, putative	0.0066	0.0639	0.2088
Entamoeba histolytica	tubulin family protein	0.0208	0.306	1
Leishmania major	beta tubulin	0.0208	0.306	1
Schistosoma mansoni	tubulin subunit alpha	0.0054	0.0429	0.1363
Giardia lamblia	Alpha-tubulin	0.0183	0.2638	0.8393
Plasmodium falciparum	tubulin epsilon chain, putative	0.0123	0.1619	0.5291
Plasmodium vivax	tubulin alpha chain, putative	0.0183	0.2638	0.8618
Leishmania major	beta tubulin	0.0208	0.306	1
Brugia malayi	FAD binding domain containing protein	0.0074	0.0783	0.1643
Trypanosoma cruzi	tubulin gamma chain	0.0123	0.1619	0.5291
Brugia malayi	Tubulin beta chain	0.0054	0.0429	0.0899
Loa Loa (eye worm)	tubulin alpha 2	0.0129	0.1724	0.174
Brugia malayi	Tubulin gamma chain	0.0123	0.1619	0.3397
Echinococcus multilocularis	Tubulin beta 2C chain	0.0208	0.306	1
Leishmania major	epsilon tubulin, putative	0.0123	0.1619	0.5291
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Trichomonas vaginalis	NADPH fad oxidoreductase, putative	0.0066	0.0639	0.2088
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0783	0.0791
Loa Loa (eye worm)	tubulin beta-1 chain	0.0208	0.306	0.3089
Echinococcus multilocularis	tubulin alpha chain	0.0183	0.2638	0.8612
Loa Loa (eye worm)	tubulin gamma chain	0.0123	0.1619	0.1634
Trypanosoma cruzi	epsilon tubulin, putative	0.0123	0.1619	0.5291
Leishmania major	beta tubulin	0.0208	0.306	1
Brugia malayi	Tubulin alpha chain	0.0054	0.0429	0.0899
Trichomonas vaginalis	conserved hypothetical protein	0.0054	0.0429	0.14
Mycobacterium tuberculosis	Cell division protein FtsZ	0.0054	0.0429	0.1446
Echinococcus granulosus	survival motor neuron protein 1	0.0192	0.2788	0.9106
Entamoeba histolytica	tubulin gamma chain	0.0123	0.1619	0.5291
Schistosoma mansoni	cytochrome P450 reductase	0.0074	0.0783	0.2527
Echinococcus multilocularis	beta tubulin	0.0208	0.306	1
Schistosoma mansoni	tubulin subunit gamma	0.0123	0.1619	0.527
Echinococcus granulosus	tubulin alpha chain	0.0183	0.2638	0.8612
Plasmodium falciparum	alpha tubulin 2	0.0183	0.2638	0.8618
Brugia malayi	beta-tubulin, identical	0.0208	0.306	0.6421
Echinococcus multilocularis	hypothetical protein	0.0183	0.2638	0.8612
Loa Loa (eye worm)	alpha-tubulin isotype 2	0.0129	0.1724	0.174
Trypanosoma brucei	alpha tubulin, putative	0.007	0.0706	0.2305
Plasmodium falciparum	nitric oxide synthase, putative	0.0074	0.0783	0.2559
Schistosoma mansoni	tubulin subunit beta	0.0208	0.306	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0208	0.306	1
Plasmodium falciparum	tubulin beta chain	0.0208	0.306	1
Trypanosoma brucei	tubulin delta chain	0.0054	0.0429	0.14
Loa Loa (eye worm)	FAD binding domain-containing protein	0.0046	0.0298	0.0301
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0169	0.2396	0.2418
Echinococcus granulosus	tubulin alpha chain	0.0183	0.2638	0.8612
Echinococcus multilocularis	tubulin alpha chain	0.0183	0.2638	0.8612
Leishmania major	alpha tubulin	0.0183	0.2638	0.8618
Plasmodium falciparum	alpha tubulin 1	0.0183	0.2638	0.8618
Schistosoma mansoni	tubulin subunit beta	0.0208	0.306	1
Trichomonas vaginalis	tubulin, putative	0.0054	0.0429	0.14
Echinococcus granulosus	tubulin beta 4A class IVa	0.0208	0.306	1
Echinococcus multilocularis	NADPH dependent diflavin oxidoreductase 1	0.0074	0.0783	0.2527
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0043	0.0243	0.08
Echinococcus multilocularis	NADPH cytochrome P450 reductase	0.0074	0.0783	0.2527
Plasmodium vivax	tubulin alpha chain, putative	0.0183	0.2638	0.8618
Echinococcus granulosus	Tubulin alpha 1 chain	0.0183	0.2638	0.8612
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0054	0.0429	0.14
Toxoplasma gondii	flavodoxin domain-containing protein	0.0037	0.0144	0.043
Plasmodium vivax	tubulin epsilon chain, putative	0.0123	0.1619	0.5291
Trichomonas vaginalis	tubulin, putative	0.007	0.0706	0.2305
Echinococcus granulosus	tubulin alpha chain	0.0183	0.2638	0.8612
Trypanosoma cruzi	tubulin delta chain	0.0054	0.0429	0.14
Brugia malayi	beta-lactamase family protein	0.0029	0.0013	0.0028
Onchocerca volvulus		0.007	0.0711	0.0699

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 11.8 nM	Inhibition of soluble epoxide hydroxylase by kinetic fluorescent assay	ChEMBL.	16870439
IC50 (binding)	= 11.8 nM	Inhibition of soluble epoxide hydroxylase by kinetic fluorescent assay	ChEMBL.	16870439
IC50 (binding)	= 11.8 nM	BindingDB_Patents: Inhibition Assay. Inhibition assay of human soluble epoxide hydrolases.	ChEMBL.	No reference
IC50 (binding)	= 11.8 nM	BindingDB_Patents: Inhibition Assay. Inhibition assay of human soluble epoxide hydrolases.	ChEMBL.	No reference

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: CHEMBL387280

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 373423