TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 410.481 | Formula: C20H26O7S
H donors: 0 H acceptors: 4 LogP: 2.25 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CC(=O)CC(=O)OC1(C)CCC2CC1OO[C@@]2(C)CS(=O)(=O)c1ccccc1
InChi: 1S/C20H26O7S/c1-14(21)11-18(22)25-19(2)10-9-15-12-17(19)26-27-20(15,3)13-28(23,24)16-7-5-4-6-8-16/h4-8,15,17H,9-13H2,1-3H3/t15?,17?,19?,20-/m0/s1
InChiKey: HCWPVEPAEIXZGC-OYQRTFSISA-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
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.00312251	0.00610192	0.00736069
Trichomonas vaginalis	tubulin beta-1 chain, putative	0.0116386	0.155121	0.178148
Echinococcus granulosus	NADPH cytochrome P450 reductase	0.00429386	0.0265988	0.0320859
Plasmodium falciparum	tubulin gamma chain	0.0268054	0.420518	0.503613
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0370531	0.599836	0.723577
Plasmodium vivax	NADPH-cytochrome p450 reductase, putative	0.00429386	0.0265988	0.0249086
Brugia malayi	SWIRM domain containing protein	0.00421982	0.0253032	0.0300303
Brugia malayi	Tubulin beta chain	0.0151668	0.21686	0.257372
Wolbachia endosymbiont of Brugia malayi	cell division protein FtsZ	0.0116386	0.155121	0.5
Brugia malayi	Animal haem peroxidase family protein	0.00293349	0.00279433	0.00331635
Toxoplasma gondii	beta-1 tubulin, putative	0.0501485	0.828987	1
Echinococcus multilocularis	lysine specific histone demethylase 1A	0.00421982	0.0253032	0.0305231
Plasmodium falciparum	tubulin delta chain, putative	0.0116386	0.155121	0.181093
Mycobacterium leprae	cell division protein FtsZ	0.0116386	0.155121	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0501485	0.828987	0.983737
Echinococcus granulosus	tubulin alpha chain	0.0370531	0.599836	0.723577
Schistosoma mansoni	tumor necrosis factor receptor related	0.0152465	0.218254	0.263278
Leishmania major	cytochrome P450 reductase, putative	0.00393936	0.0203955	0.01737
Giardia lamblia	Beta tubulin	0.0501485	0.828987	0.983454
Echinococcus granulosus	lysine specific histone demethylase 1A	0.00421982	0.0253032	0.0305231
Trichomonas vaginalis	tubulin gamma chain, putative	0.0268054	0.420518	0.495423
Leishmania major	beta tubulin	0.0501485	0.828987	1
Echinococcus multilocularis	tubulin alpha chain	0.0370531	0.599836	0.723577
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Leishmania major	beta tubulin	0.0501485	0.828987	1
Trypanosoma cruzi	epsilon tubulin, putative	0.0268054	0.420518	0.491753
Schistosoma mansoni	tubulin subunit beta	0.0501485	0.828987	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0370531	0.599836	0.709793
Echinococcus granulosus	Tubulin alpha 1 chain	0.0370531	0.599836	0.723577
Schistosoma mansoni	netrin receptor unc5	0.0118572	0.158946	0.191735
Loa Loa (eye worm)	animal heme peroxidase	0.00293349	0.00279433	0.00331635
Schistosoma mansoni	tubulin subunit beta	0.0501485	0.828987	1
Brugia malayi	Blistered cuticle protein 3	0.00293349	0.00279433	0.00331635
Loa Loa (eye worm)	animal heme peroxidase	0.00293349	0.00279433	0.00331635
Schistosoma mansoni	hypothetical protein	0.0118572	0.158946	0.191735
Echinococcus multilocularis	peroxisome assembly protein 26	0.0370531	0.599836	0.723577
Leishmania major	beta tubulin	0.0501485	0.828987	1
Schistosoma mansoni	amine oxidase	0.00421982	0.0253032	0.0305231
Trichomonas vaginalis	tubulin beta chain, putative	0.0370531	0.599836	0.709793
Brugia malayi	flavodoxin family protein	0.00429386	0.0265988	0.0315679
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0370531	0.599836	0.709793
Schistosoma mansoni	peroxidasin	0.00293349	0.00279433	0.00337078
Echinococcus multilocularis		0.00421982	0.0253032	0.0305231
Loa Loa (eye worm)	hypothetical protein	0.00429386	0.0265988	0.0315679
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0509259	0.842591	1
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.00312251	0.00610192	0.00736069
Brugia malayi	hypothetical protein	0.00293349	0.00279433	0.00331635
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0509259	0.842591	1
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0165748	0.241498	0.291317
Trypanosoma cruzi	zeta tubulin, putative	0.0116386	0.155121	0.161528
Brugia malayi	Cation transporter family protein	0.0165748	0.241498	0.286613
Plasmodium vivax	hypothetical protein, conserved	0.00421982	0.0253032	0.0233341
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0509259	0.842591	1
Loa Loa (eye worm)	hypothetical protein	0.00421982	0.0253032	0.0300303
Trichomonas vaginalis	tubulin alpha chain, putative	0.0151668	0.21686	0.251955
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0165748	0.241498	0.291317
Schistosoma mansoni	Protoporphyrinogen oxidase chloroplast/mitochondrial precursor	0.00421982	0.0253032	0.0305231
Echinococcus granulosus	tubulin beta 1 chain	0.0501485	0.828987	1
Echinococcus multilocularis	NADPH cytochrome P450 reductase	0.00429386	0.0265988	0.0320859
Brugia malayi	Tubulin gamma chain	0.0268054	0.420518	0.499077
Loa Loa (eye worm)	tubulin alpha-3 chain	0.0218862	0.334439	0.396918
Schistosoma mansoni	hypothetical protein	0.013048	0.179784	0.216872
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0370531	0.599836	0.723577
Loa Loa (eye worm)	hypothetical protein	0.00421982	0.0253032	0.0300303
Loa Loa (eye worm)	tubulin alpha 2	0.0254145	0.396178	0.47019
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Brugia malayi	Tubulin alpha-2 chain	0.0370531	0.599836	0.711895
Echinococcus granulosus	Tubulin beta 2C chain	0.0501485	0.828987	1
Schistosoma mansoni	tubulin subunit beta	0.0501485	0.828987	1
Echinococcus multilocularis	tubulin alpha chain	0.0370531	0.599836	0.723577
Brugia malayi	ABC transporter family protein	0.0131015	0.180719	0.21448
Loa Loa (eye worm)	tubulin beta-1 chain	0.0501485	0.828987	0.983855
Brugia malayi	amine oxidase, flavin-containing family protein	0.00421982	0.0253032	0.0300303
Trichomonas vaginalis	tubulin alpha chain, putative	0.0151668	0.21686	0.251955
Schistosoma mansoni	tubulin subunit beta	0.0501485	0.828987	1
Trichomonas vaginalis	tubulin, putative	0.0116386	0.155121	0.178148
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Trichomonas vaginalis	tubulin alpha chain, putative	0.0501485	0.828987	0.983737
Brugia malayi	Animal haem peroxidase family protein	0.00293349	0.00279433	0.00331635
Brugia malayi	ABC transporter family protein	0.00312251	0.00610192	0.00724185
Echinococcus granulosus	death domain containing protein	0.0118572	0.158946	0.191735
Echinococcus granulosus	tubulin subunit beta	0.0501485	0.828987	1
Echinococcus granulosus	ankyrin repeat and death domain containing protein	0.0118572	0.158946	0.191735
Plasmodium falciparum	tubulin beta chain	0.0501485	0.828987	1
Leishmania major	beta tubulin	0.0501485	0.828987	1
Brugia malayi	Death domain containing protein	0.0118572	0.158946	0.188639
Plasmodium falciparum	ABC transporter G family member 2	0.0153798	0.220587	0.26065
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Echinococcus multilocularis	tubulin alpha chain	0.0370531	0.599836	0.723577
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.00312251	0.00610192	0.00736069
Leishmania major	beta tubulin	0.0501485	0.828987	1
Echinococcus granulosus	Tubulin beta 2C chain	0.0501485	0.828987	1
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0509259	0.842591	1
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0254145	0.396178	0.466325
Echinococcus granulosus	tumor necrosis factor receptor superfamily	0.0152465	0.218254	0.263278
Giardia lamblia	Delta tubulin	0.0116386	0.155121	0.16386
Giardia lamblia	Alpha-tubulin	0.0370531	0.599836	0.704748
Trichomonas vaginalis	tubulin beta chain, putative	0.0151668	0.21686	0.251955
Trichomonas vaginalis	tubulin gamma chain, putative	0.0116386	0.155121	0.178148
Loa Loa (eye worm)	animal heme peroxidase	0.00293349	0.00279433	0.00331635
Schistosoma mansoni	alpha tubulin	0.0370531	0.599836	0.723577
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Plasmodium falciparum	alpha tubulin 1	0.0370531	0.599836	0.721527
Leishmania major	beta tubulin	0.0501485	0.828987	1
Loa Loa (eye worm)	FAD binding domain-containing protein	0.00429386	0.0265988	0.0315679
Plasmodium vivax	ABC transporter G family member 2, putative	0.0153798	0.220587	0.26065
Echinococcus granulosus	multidrug resistance protein 1	0.00312251	0.00610192	0.00736069
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0151668	0.21686	0.251955
Loa Loa (eye worm)	tubulin alpha chain	0.0370531	0.599836	0.711895
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Loa Loa (eye worm)	tubulin alpha 2	0.0102476	0.130781	0.155213
Echinococcus granulosus	ATP binding cassette sub family G	0.0153798	0.220587	0.266092
Trichomonas vaginalis	tubulin gamma chain, putative	0.0268054	0.420518	0.495423
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0370531	0.599836	0.711895
Trypanosoma brucei	epsilon tubulin	0.0268054	0.420518	0.490933
Echinococcus multilocularis	tubulin alpha 3 chain	0.0370531	0.599836	0.723577
Leishmania major	gamma-tubulin	0.0268054	0.420518	0.503613
Entamoeba histolytica	tubulin gamma chain	0.0268054	0.420518	0.495423
Trypanosoma cruzi	tubulin delta chain	0.0116386	0.155121	0.161528
Brugia malayi	Cell division protein ftsZ	0.0116386	0.155121	0.1841
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0153798	0.220587	0.200354
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0153798	0.220587	0.200354
Plasmodium vivax	protoporphyrinogen oxidase, putative	0.00421982	0.0253032	0.0233341
Echinococcus granulosus	Tubulin beta 2C chain	0.0501485	0.828987	1
Loa Loa (eye worm)	BEN-1 protein	0.0501485	0.828987	0.983855
Brugia malayi	Tubulin alpha chain	0.0116386	0.155121	0.1841
Echinococcus multilocularis	Tubulin beta 2C chain	0.0501485	0.828987	1
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0116386	0.155121	0.181093
Plasmodium vivax	delta tubulin, putative	0.0116386	0.155121	0.181093
Echinococcus granulosus	ATP binding cassette sub family G	0.0153798	0.220587	0.266092
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0370531	0.599836	0.709793
Chlamydia trachomatis	ABC transporter ATP binding protein/permease	0.00312251	0.00610192	0.241152
Schistosoma mansoni	multidrug resistance protein	0.00312251	0.00610192	0.00736069
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0116386	0.155121	0.178148
Echinococcus multilocularis	tubulin epsilon chain	0.0268054	0.420518	0.507267
Plasmodium falciparum	lysine-specific histone demethylase 1, putative	0.00421982	0.0253032	0.0233341
Loa Loa (eye worm)	tubulin beta chain	0.0116386	0.155121	0.1841
Echinococcus multilocularis	tumor necrosis factor receptor superfamily	0.0152465	0.218254	0.263278
Echinococcus granulosus	tubulin alpha 1C chain	0.0370531	0.599836	0.723577
Loa Loa (eye worm)	BEN-1 protein	0.0501485	0.828987	0.983855
Brugia malayi	Tubulin beta chain	0.0116386	0.155121	0.1841
Leishmania major	beta tubulin	0.0501485	0.828987	1
Echinococcus multilocularis	tubulin alpha chain	0.0370531	0.599836	0.723577
Trypanosoma brucei	ABC transporter, putative	0.0153798	0.220587	0.241764
Echinococcus multilocularis	tubulin alpha 1C chain	0.0370531	0.599836	0.723577
Brugia malayi	Animal haem peroxidase family protein	0.00293349	0.00279433	0.00331635
Loa Loa (eye worm)	hypothetical protein	0.0118572	0.158946	0.188639
Giardia lamblia	Alpha-tubulin	0.0370531	0.599836	0.704748
Loa Loa (eye worm)	hypothetical protein	0.00312251	0.00610192	0.00724185
Loa Loa (eye worm)	hypothetical protein	0.0118572	0.158946	0.188639
Echinococcus multilocularis	beta tubulin	0.0501485	0.828987	1
Loa Loa (eye worm)	beta-tubulin	0.0501485	0.828987	0.983855
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0509259	0.842591	1
Trypanosoma cruzi	NADPH-dependent FMN/FAD containing oxidoreductase, putative	0.00429386	0.0265988	0.00161205
Trypanosoma brucei	beta tubulin	0.0501485	0.828987	1
Plasmodium vivax	hypothetical protein, conserved	0.00421982	0.0253032	0.0233341
Echinococcus multilocularis	tubulin beta 1 chain	0.0501485	0.828987	1
Entamoeba histolytica	tubulin family protein	0.0501485	0.828987	0.983737
Echinococcus granulosus	Tubulin alpha 1 chain	0.0370531	0.599836	0.723577
Leishmania major	beta tubulin	0.0501485	0.828987	1
Loa Loa (eye worm)	hypothetical protein	0.0165748	0.241498	0.286613
Schistosoma mansoni	alpha tubulin	0.0370531	0.599836	0.723577
Mycobacterium ulcerans	cell division protein FtsZ	0.0116386	0.155121	0.133188
Trypanosoma cruzi	beta tubulin, putative	0.0501485	0.828987	1
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0370531	0.599836	0.709793
Leishmania major	beta tubulin	0.0501485	0.828987	1
Echinococcus multilocularis	peroxidasin	0.00293349	0.00279433	0.00337078
Echinococcus granulosus	tubulin alpha 3 chain	0.0370531	0.599836	0.723577
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Echinococcus granulosus	NADPH dependent diflavin oxidoreductase 1	0.00429386	0.0265988	0.0320859
Plasmodium vivax	tubulin gamma chain, putative	0.0268054	0.420518	0.503613
Schistosoma mansoni	alpha tubulin	0.0370531	0.599836	0.723577
Trypanosoma brucei	zeta tubulin, putative	0.0116386	0.155121	0.160174
Mycobacterium tuberculosis	Conserved hypothetical protein	0.00421982	0.0253032	0.0208697
Echinococcus multilocularis	ATP binding cassette sub family B	0.00306908	0.00516683	0.0062327
Echinococcus granulosus	beta tubulin	0.0501485	0.828987	1
Trypanosoma brucei	alpha tubulin	0.0370531	0.599836	0.714414
Trypanosoma brucei	alpha tubulin	0.0370531	0.599836	0.714414
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Echinococcus granulosus	multidrug resistance protein 1	0.00312251	0.00610192	0.00736069
Echinococcus multilocularis	tubulin alpha chain	0.0370531	0.599836	0.723577
Trypanosoma brucei	tubulin delta chain	0.0116386	0.155121	0.160174
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.00312251	0.00610192	0.00736069
Echinococcus granulosus	tubulin delta chain	0.0116386	0.155121	0.187121
Schistosoma mansoni	smdr2	0.00312251	0.00610192	0.00736069
Schistosoma mansoni	amine oxidase	0.00421982	0.0253032	0.0305231
Brugia malayi	tubulin alpha-2 chain	0.0370531	0.599836	0.711895
Loa Loa (eye worm)	hypothetical protein	0.00312251	0.00610192	0.00724185
Loa Loa (eye worm)	tubulin alpha chain	0.0370531	0.599836	0.711895
Echinococcus granulosus	beta tubulin	0.0501485	0.828987	1
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Toxoplasma gondii	beta-tubulin, putative	0.0501485	0.828987	1
Loa Loa (eye worm)	animal heme peroxidase	0.00293349	0.00279433	0.00331635
Toxoplasma gondii	ATP-binding cassette G family transporter ABCG84	0.0153798	0.220587	0.26065
Trypanosoma cruzi	p450 reductase, putative	0.00429386	0.0265988	0.00161205
Trypanosoma brucei	epsilon tubulin	0.0268054	0.420518	0.490933
Loa Loa (eye worm)	blistered cuticle protein 3	0.00293349	0.00279433	0.00331635
Echinococcus multilocularis	tubulin alpha 1C chain	0.0370531	0.599836	0.723577
Onchocerca volvulus		0.0509259	0.842591	1
Echinococcus multilocularis	tubulin delta chain	0.0116386	0.155121	0.187121
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0153798	0.220587	0.200354
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.00312251	0.00610192	0.00736069
Brugia malayi	Tubulin alpha chain	0.0370531	0.599836	0.711895
Trypanosoma brucei	alpha tubulin	0.0370531	0.599836	0.714414
Plasmodium falciparum	protoporphyrinogen oxidase	0.00421982	0.0253032	0.0233341
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Trichomonas vaginalis	tubulin gamma chain, putative	0.0501485	0.828987	0.983737
Giardia lamblia	Low molecular weight protein-tyrosine-phosphatase	0.0509259	0.842591	1
Brugia malayi	Animal haem peroxidase family protein	0.00293349	0.00279433	0.00331635
Leishmania major	p450 reductase, putative	0.00429386	0.0265988	0.0249086
Trypanosoma brucei	beta tubulin	0.0501485	0.828987	1
Plasmodium falciparum	nitric oxide synthase, putative	0.00429386	0.0265988	0.0249086
Brugia malayi	Tubulin alpha-2 chain	0.0370531	0.599836	0.711895
Echinococcus multilocularis	multidrug resistance protein 1	0.00312251	0.00610192	0.00736069
Echinococcus granulosus	Tubulin alpha 1 chain	0.0370531	0.599836	0.723577
Trichomonas vaginalis	tubulin, putative	0.0151668	0.21686	0.251955
Loa Loa (eye worm)	ABC transporter	0.0131015	0.180719	0.21448
Trypanosoma cruzi	tubulin gamma chain	0.0268054	0.420518	0.491753
Schistosoma mansoni	ABC transporter	0.0131015	0.180719	0.218
Mycobacterium tuberculosis	Probable conserved transmembrane ATP-binding protein ABC transporter	0.013048	0.179784	0.188773
Loa Loa (eye worm)	tubulin beta-2A chain	0.0501485	0.828987	0.983855
Loa Loa (eye worm)	phosphotyrosine protein phosphatase	0.0509259	0.842591	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0501485	0.828987	1
Onchocerca volvulus		0.0165748	0.241498	0.284239
Trypanosoma cruzi	cytochrome P450 reductase, putative	0.00429386	0.0265988	0.00161205
Trypanosoma cruzi	zeta tubulin, putative	0.0116386	0.155121	0.161528
Echinococcus multilocularis	tubulin subunit TubB	0.0370531	0.599836	0.723577
Echinococcus granulosus	tubulin beta 4A class IVa	0.0501485	0.828987	1
Schistosoma mansoni	tubulin subunit alpha	0.0116386	0.155121	0.187121
Loa Loa (eye worm)	hypothetical protein	0.0218862	0.334439	0.396918
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.00421982	0.0253032	0.0233341
Schistosoma mansoni	tubulin subunit alpha	0.0370531	0.599836	0.723577
Plasmodium vivax	tubulin alpha chain, putative	0.0370531	0.599836	0.721527
Schistosoma mansoni	retinoblastoma-binding protein 4 (rbbp4)	0.0118572	0.158946	0.191735
Schistosoma mansoni	tubulin subunit gamma	0.0268054	0.420518	0.507267
Echinococcus multilocularis	netrin receptor unc 5	0.0118572	0.158946	0.191735
Trichomonas vaginalis	conserved hypothetical protein	0.0116386	0.155121	0.178148
Echinococcus granulosus	ATP binding cassette sub family G	0.0153798	0.220587	0.266092
Trichomonas vaginalis	tubulin alpha chain, putative	0.0268054	0.420518	0.495423
Trichomonas vaginalis	tubulin beta chain, putative	0.0370531	0.599836	0.709793
Echinococcus granulosus	Tubulin beta 2C chain	0.0501485	0.828987	1
Onchocerca volvulus		0.0151668	0.21686	0.254901
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0370531	0.599836	0.723577
Echinococcus multilocularis	TNFR CD27 30 40 95 cysteine rich region	0.0152465	0.218254	0.263278
Schistosoma mansoni	tubulin subunit alpha	0.0370531	0.599836	0.723577
Echinococcus multilocularis	Ankyrin	0.0118572	0.158946	0.191735
Schistosoma mansoni	tubulin subunit delta	0.0116386	0.155121	0.187121
Trypanosoma brucei	beta tubulin	0.0268054	0.420518	0.490933
Echinococcus multilocularis	tubulin alpha 3 chain	0.0370531	0.599836	0.723577
Schistosoma mansoni	ATP-binding cassette sub-family g2 (white protein) (abcg2)	0.0153798	0.220587	0.266092
Plasmodium vivax	flavodoxin domain containing protein	0.00393936	0.0203955	0.01737
Echinococcus granulosus	TNFR CD27 30 40 95 cysteine rich region	0.0152465	0.218254	0.263278
Echinococcus multilocularis	ATP binding cassette sub family G	0.0153798	0.220587	0.266092
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Loa Loa (eye worm)	hypothetical protein	0.00421982	0.0253032	0.0300303
Trypanosoma brucei	beta tubulin	0.0501485	0.828987	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0370531	0.599836	0.709793
Loa Loa (eye worm)	hypothetical protein	0.00306908	0.00516683	0.00613207
Schistosoma mansoni	multidrug resistance protein	0.00312251	0.00610192	0.00736069
Echinococcus granulosus	tubulin alpha	0.0268054	0.420518	0.507267
Trichomonas vaginalis	tubulin beta chain, putative	0.0370531	0.599836	0.709793
Trypanosoma brucei	tubulin gamma chain	0.0268054	0.420518	0.490933
Brugia malayi	multidrug resistance protein 3	0.00312251	0.00610192	0.00724185
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0501485	0.828987	0.983737
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0599215	1	1
Schistosoma mansoni	alzheimer's disease beta-amyloid related	0.0180186	0.266761	0.321792
Echinococcus multilocularis	hypothetical protein	0.0370531	0.599836	0.723577
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0218862	0.334439	0.392518
Chlamydia trachomatis	protoporphyrinogen oxidase	0.00421982	0.0253032	1
Schistosoma mansoni	tubulin subunit beta	0.0501485	0.828987	1
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.00312251	0.00610192	0.00736069
Leishmania major	ATP-binding cassette protein subfamily G, member 6, putative	0.0153798	0.220587	0.26065
Loa Loa (eye worm)	tubulin alpha 2	0.0254145	0.396178	0.47019
Mycobacterium tuberculosis	Cell division protein FtsZ	0.0116386	0.155121	0.161967
Plasmodium vivax	tubulin beta chain, putative	0.0501485	0.828987	1
Loa Loa (eye worm)	hypothetical protein	0.0105638	0.136313	0.161778
Echinococcus granulosus	tubulin epsilon chain	0.0268054	0.420518	0.507267
Echinococcus granulosus	netrin receptor unc 5	0.0118572	0.158946	0.191735
Echinococcus granulosus	tubulin alpha 1C chain	0.0370531	0.599836	0.723577
Trypanosoma brucei	epsilon tubulin	0.0268054	0.420518	0.490933
Giardia lamblia	Gamma tubulin	0.0268054	0.420518	0.486651
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Echinococcus multilocularis	NADPH dependent diflavin oxidoreductase 1	0.00429386	0.0265988	0.0320859
Loa Loa (eye worm)	tubulin beta-4 chain	0.0501485	0.828987	0.983855
Echinococcus multilocularis	Tubulin beta 2C chain	0.0501485	0.828987	1
Entamoeba histolytica	tubulin alpha-1 chain	0.0370531	0.599836	0.709793
Loa Loa (eye worm)	hypothetical protein	0.00421982	0.0253032	0.0300303
Loa Loa (eye worm)	hypothetical protein	0.00421982	0.0253032	0.0300303
Trichomonas vaginalis	NADPH fad oxidoreductase, putative	0.00393936	0.0203955	0.0170875
Trypanosoma cruzi	alpha tubulin, putative	0.0370531	0.599836	0.714874
Loa Loa (eye worm)	hypothetical protein	0.0390811	0.635324	0.754013
Leishmania major	beta tubulin	0.0501485	0.828987	1
Mycobacterium tuberculosis	Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase)	0.0509259	0.842591	0.909171
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0509259	0.842591	1
Echinococcus granulosus	peroxisome assembly protein 26	0.0370531	0.599836	0.723577
Plasmodium falciparum	alpha tubulin 2	0.0370531	0.599836	0.721527
Plasmodium vivax	tubulin epsilon chain, putative	0.0268054	0.420518	0.503613
Echinococcus granulosus	multidrug resistance protein 1	0.00312251	0.00610192	0.00736069
Loa Loa (eye worm)	alpha-tubulin	0.0370531	0.599836	0.711895
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0501485	0.828987	1
Loa Loa (eye worm)	multidrug resistance protein 3	0.00312251	0.00610192	0.00724185
Echinococcus granulosus	Tubulin beta 2C chain	0.0501485	0.828987	1
Trypanosoma cruzi	ABC transporter, putative	0.0153798	0.220587	0.242986
Toxoplasma gondii	beta tubulin	0.0501485	0.828987	1
Brugia malayi	tubulin alpha chain - mouse	0.0370531	0.599836	0.711895
Giardia lamblia	Beta tubulin	0.0501485	0.828987	0.983454
Toxoplasma gondii	alpha tubulin TUBA1	0.0370531	0.599836	0.721527
Trichomonas vaginalis	tubulin, putative	0.0501485	0.828987	0.983737
Leishmania major	beta tubulin	0.0501485	0.828987	1
Toxoplasma gondii	histone lysine-specific demethylase LSD1/BHC110/KDMA1A	0.00421982	0.0253032	0.0233341
Loa Loa (eye worm)	hypothetical protein	0.0254145	0.396178	0.47019
Brugia malayi	Peroxidasin	0.00293349	0.00279433	0.00331635
Giardia lamblia	ABC transporter	0.0153264	0.219652	0.242347
Echinococcus multilocularis	tubulin alpha	0.0268054	0.420518	0.507267
Trypanosoma cruzi	ATP-binding cassette protein, putative	0.0153798	0.220587	0.242986
Trypanosoma brucei	ATP-binding cassette protein, putative	0.0153798	0.220587	0.241764
Schistosoma mansoni	cytochrome P450 reductase	0.00429386	0.0265988	0.0320859
Loa Loa (eye worm)	alpha-tubulin isotype 2	0.0254145	0.396178	0.47019
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Entamoeba histolytica	tubulin alpha chain, putative	0.0370531	0.599836	0.709793
Leishmania major	zeta tubulin, putative	0.0116386	0.155121	0.181093
Echinococcus granulosus	lysine specific histone demethylase 1A	0.00421982	0.0253032	0.0305231
Loa Loa (eye worm)	hypothetical protein	0.0370531	0.599836	0.711895
Toxoplasma gondii	alpha-tubulin I, putative	0.0370531	0.599836	0.721527
Leishmania major	ATP-binding cassette protein subfamily G, member 4, putative	0.0153798	0.220587	0.26065
Echinococcus granulosus	5'partial\|ATP binding cassette sub family B	0.00306908	0.00516683	0.0062327
Entamoeba histolytica	ABC transporter, putative	0.0153798	0.220587	0.256411
Trichomonas vaginalis	tubulin beta chain, putative	0.0370531	0.599836	0.709793
Echinococcus granulosus	tubulin gamma 1 chain	0.0268054	0.420518	0.507267
Plasmodium vivax	tubulin alpha chain, putative	0.0370531	0.599836	0.721527
Echinococcus granulosus	tubulin alpha chain	0.0370531	0.599836	0.723577
Brugia malayi	Animal haem peroxidase family protein	0.00293349	0.00279433	0.00331635
Loa Loa (eye worm)	alpha-tubulin	0.0370531	0.599836	0.711895
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0116386	0.155121	0.181093
Schistosoma mansoni	tubulin subunit beta	0.0116386	0.155121	0.187121
Trypanosoma brucei	alpha tubulin	0.0370531	0.599836	0.714414
Leishmania major	beta tubulin	0.0501485	0.828987	1
Trypanosoma cruzi	cytochrome P450 reductase, putative	0.00429386	0.0265988	0.00161205
Onchocerca volvulus		0.00421982	0.0253032	0.0268028
Echinococcus granulosus	tubulin alpha chain	0.0370531	0.599836	0.723577
Echinococcus multilocularis	Tubulin beta 2C chain	0.0501485	0.828987	1
Echinococcus granulosus	tubulin alpha chain	0.0370531	0.599836	0.723577
Brugia malayi	hypothetical protein	0.00421982	0.0253032	0.0300303
Trichomonas vaginalis	tubulin, putative	0.0151668	0.21686	0.251955
Brugia malayi	beta-tubulin, identical	0.0501485	0.828987	0.983855
Leishmania major	beta tubulin	0.0501485	0.828987	1
Leishmania major	epsilon tubulin, putative	0.0268054	0.420518	0.503613
Treponema pallidum	cell division protein FtsZ	0.0116386	0.155121	0.5
Mycobacterium ulcerans	phosphotyrosine protein phosphatase PtpA	0.0509259	0.842591	0.838505
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Trichomonas vaginalis	tubulin alpha chain, putative	0.0151668	0.21686	0.251955
Schistosoma mansoni	tubulin subunit beta	0.0501485	0.828987	1
Echinococcus granulosus	tubulin alpha chain	0.0370531	0.599836	0.723577
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0509259	0.842591	1
Leishmania major	UDP-galactopyranose mutase	0.00421982	0.0253032	0.0233341
Trichomonas vaginalis	conserved hypothetical protein	0.0116386	0.155121	0.178148
Brugia malayi	Amyloid A4 extracellular domain containing protein	0.0495799	0.819037	0.972046
Echinococcus multilocularis	ATP binding cassette sub family G	0.0153798	0.220587	0.266092
Schistosoma mansoni	peroxidasin	0.00293349	0.00279433	0.00337078
Echinococcus granulosus	peroxidasin	0.00293349	0.00279433	0.00337078
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Leishmania major	delta tubulin, putative	0.0116386	0.155121	0.181093
Toxoplasma gondii	histone lysine-specific demethylase	0.00421982	0.0253032	0.0233341
Onchocerca volvulus		0.0165748	0.241498	0.284239
Plasmodium falciparum	tubulin epsilon chain, putative	0.0268054	0.420518	0.503613
Brugia malayi	alpha-tubulin	0.0370531	0.599836	0.711895
Onchocerca volvulus	Netrin receptor homolog	0.0118572	0.158946	0.18594
Echinococcus multilocularis	ATP binding cassette sub family G	0.0153798	0.220587	0.266092
Brugia malayi	Low molecular weight phosphotyrosine protein phosphatase containing protein	0.0509259	0.842591	1
Trypanosoma brucei	zeta tubulin	0.0116386	0.155121	0.160174
Trypanosoma brucei	alpha tubulin, putative	0.0151668	0.21686	0.237118
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0118572	0.158946	0.188639
Trypanosoma brucei	beta tubulin	0.0501485	0.828987	1
Entamoeba histolytica	tubulin family protein	0.0501485	0.828987	0.983737
Loa Loa (eye worm)	tubulin gamma chain	0.0268054	0.420518	0.499077
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Schistosoma mansoni	tubulin subunit epsilon	0.0268054	0.420518	0.507267
Brugia malayi	Tubulin beta-1 chain	0.0501485	0.828987	0.983855
Plasmodium vivax	lysine-specific histone demethylase 1, putative	0.00421982	0.0253032	0.0233341
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0599215	1	1
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.00312251	0.00610192	0.00736069
Echinococcus multilocularis	multidrug resistance protein 1	0.00312251	0.00610192	0.00736069
Mycobacterium tuberculosis	Possible oxidoreductase	0.00421982	0.0253032	0.0208697
Schistosoma mansoni	tubulin subunit alpha	0.0370531	0.599836	0.723577
Echinococcus multilocularis	tubulin gamma 1 chain	0.0268054	0.420518	0.507267
Leishmania major	beta tubulin	0.0501485	0.828987	1
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.00312251	0.00610192	0.00736069
Loa Loa (eye worm)	ATP-binding cassette sub-family B member 2	0.00312251	0.00610192	0.00724185
Mycobacterium ulcerans	formate dehydrogenase H FdhF	0.00429386	0.0265988	0.00132921
Leishmania major	beta tubulin	0.0501485	0.828987	1
Leishmania major	alpha tubulin	0.0370531	0.599836	0.721527
Echinococcus granulosus	alpha tubulin	0.0370531	0.599836	0.723577
Leishmania major	beta tubulin	0.0501485	0.828987	1
Echinococcus granulosus	tubulin subunit TubB	0.0370531	0.599836	0.723577
Giardia lamblia	Beta tubulin	0.0501485	0.828987	0.983454
Loa Loa (eye worm)	hypothetical protein	0.0210625	0.320026	0.379812
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0509259	0.842591	1
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Echinococcus multilocularis	beta tubulin	0.0501485	0.828987	1
Loa Loa (eye worm)	tubulin beta chain	0.0501485	0.828987	0.983855
Brugia malayi	FAD binding domain containing protein	0.00429386	0.0265988	0.0315679
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Trichomonas vaginalis	sulfite reductase, putative	0.00429386	0.0265988	0.0245035
Brugia malayi	Uncoordinated protein 44	0.0118572	0.158946	0.188639
Echinococcus multilocularis	tubulin subunit beta	0.0501485	0.828987	1
Echinococcus multilocularis	ankyrin repeat and death domain containing protein	0.0118572	0.158946	0.191735
Loa Loa (eye worm)	hypothetical protein	0.00421982	0.0253032	0.0300303
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0501485	0.828987	0.983737
Loa Loa (eye worm)	hypothetical protein	0.0154298	0.221462	0.262834
Trypanosoma cruzi	tubulin delta chain	0.0116386	0.155121	0.161528
Onchocerca volvulus		0.00312251	0.00610192	0.00393856
Schistosoma mansoni	Lysine-specific histone demethylase 1	0.00421982	0.0253032	0.0305231
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0118572	0.158946	0.188639
Mycobacterium tuberculosis	Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO)	0.0557017	0.926159	1
Trypanosoma cruzi	epsilon tubulin, putative	0.0268054	0.420518	0.491753
Echinococcus multilocularis	Tubulin beta 2C chain	0.0501485	0.828987	1
Leishmania major	NADPH-cytochrome p450 reductase-like protein	0.00429386	0.0265988	0.0249086
Leishmania major	beta tubulin	0.0501485	0.828987	1
Schistosoma mansoni	ankyrin 23/unc44	0.0118572	0.158946	0.191735
Brugia malayi	Protein kinase domain containing protein	0.0118572	0.158946	0.188639
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.00312251	0.00610192	0.00736069
Loa Loa (eye worm)	hypothetical protein	0.00293349	0.00279433	0.00331635
Echinococcus granulosus	tubulin alpha 3 chain	0.0370531	0.599836	0.723577
Loa Loa (eye worm)	hypothetical protein	0.0165748	0.241498	0.286613
Echinococcus multilocularis	protoporphyrinogen oxidase	0.00421982	0.0253032	0.0305231
Giardia lamblia	Epsilon tubulin	0.0116386	0.155121	0.16386
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0268054	0.420518	0.503613
Onchocerca volvulus		0.0165748	0.241498	0.284239
Schistosoma mansoni	multidrug resistance protein	0.00312251	0.00610192	0.00736069
Echinococcus granulosus	Ankyrin	0.0118572	0.158946	0.191735
Leishmania major	beta tubulin	0.0501485	0.828987	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 46 nM	In vitro antimalarial activity against chloroquine-sensitive P. falciparum (NF 54)	ChEMBL.	9871509
IC50 (functional)	= 46 nM	In vitro antimalarial activity of the compound was determined against chloroquine-sensitive NF54 strain of Plasmodium falciparum	ChEMBL.	12773055
IC50 (functional)	= 46 nM	In vitro antimalarial activity against chloroquine-sensitive P. falciparum (NF 54)	ChEMBL.	9871509

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23	9871509

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: CHEMBL86069

Bibliographic References

2 literature references were collected for this gene.

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

Detailed information for compound 139159