TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 302.305 | Formula: C14H10N2O4S
H donors: 4 H acceptors: 6 LogP: 2.27 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: Oc1ccc(c(c1)O)c1nnc(s1)c1ccc(c(c1)O)O
InChi: 1S/C14H10N2O4S/c17-8-2-3-9(11(19)6-8)14-16-15-13(21-14)7-1-4-10(18)12(20)5-7/h1-6,17-20H
InChiKey: WCWJMCVRJVZEQB-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
Electrophorus electricus	Acetylcholinesterase	Starlite/ChEMBL	References
Equus caballus	Cholinesterase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	acetylcholinesterase 1	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus multilocularis	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus granulosus	carboxylesterase 5A	Get druggable targets OG5_126875	All targets in OG5_126875
Loa Loa (eye worm)	carboxylesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus granulosus	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Schistosoma japonicum	ko:K01049 acetylcholinesterase [EC3.1.1.7], putative	Get druggable targets OG5_126875	All targets in OG5_126875
Brugia malayi	Carboxylesterase family protein	Get druggable targets OG5_126875	All targets in OG5_126875
Brugia malayi	Carboxylesterase family protein	Get druggable targets OG5_126875	All targets in OG5_126875
Schistosoma japonicum	Acetylcholinesterase 1 precursor, putative	Get druggable targets OG5_126875	All targets in OG5_126875
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus multilocularis	carboxylesterase 5A	Get druggable targets OG5_126875	All targets in OG5_126875
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus granulosus	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus multilocularis	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	gliotactin	Cholinesterase	574 aa	587 aa	27.9 %
Echinococcus granulosus	neuroligin	Cholinesterase	574 aa	492 aa	24.4 %
Echinococcus multilocularis	BC026374 protein (S09 family)	Acetylcholinesterase	633 aa	690 aa	32.3 %
Drosophila melanogaster	CG10175 gene product from transcript CG10175-RE	Acetylcholinesterase	633 aa	549 aa	30.4 %
Echinococcus multilocularis	neuroligin	Acetylcholinesterase	633 aa	507 aa	23.9 %
Onchocerca volvulus		Cholinesterase	574 aa	551 aa	29.9 %
Onchocerca volvulus	Galectin homolog	Cholinesterase	574 aa	531 aa	39.7 %
Onchocerca volvulus		Acetylcholinesterase	633 aa	648 aa	25.3 %
Schistosoma japonicum	ko:K01050 cholinesterase [EC3.1.1.8], putative	Cholinesterase	574 aa	577 aa	36.9 %
Echinococcus granulosus	BC026374 protein S09 family	Acetylcholinesterase	633 aa	690 aa	31.7 %
Brugia malayi	Carboxylesterase family protein	Acetylcholinesterase	633 aa	620 aa	28.4 %
Brugia malayi	Carboxylesterase family protein	Cholinesterase	574 aa	538 aa	31.4 %
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	Acetylcholinesterase	633 aa	622 aa	24.9 %
Onchocerca volvulus		Cholinesterase	574 aa	578 aa	25.3 %
Loa Loa (eye worm)	hypothetical protein	Acetylcholinesterase	633 aa	597 aa	25.1 %
Brugia malayi	Carboxylesterase family protein	Acetylcholinesterase	633 aa	517 aa	25.1 %
Onchocerca volvulus	Putative nuclear protein	Cholinesterase	574 aa	572 aa	40.9 %
Onchocerca volvulus	Carnitine O-palmitoyltransferase 2, mitochondrial homolog	Cholinesterase	574 aa	554 aa	36.1 %
Onchocerca volvulus	Molybdopterin synthase catalytic subunit homolog	Acetylcholinesterase	633 aa	576 aa	28.8 %
Loa Loa (eye worm)	hypothetical protein	Acetylcholinesterase	633 aa	576 aa	23.4 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative	0.0073	0.0885	0.034
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Brugia malayi	Tubulin alpha-2 chain	0.0232	0.4653	0.671
Trypanosoma cruzi	alpha tubulin, putative	0.0232	0.4653	0.6215
Brugia malayi	Cell division protein ftsZ	0.0074	0.0908	0.1309
Echinococcus granulosus	Tubulin alpha 1 chain	0.0232	0.4653	0.6357
Schistosoma mansoni	tubulin subunit epsilon	0.0171	0.3206	0.4623
Echinococcus multilocularis	peroxidasin	0.008	0.1037	0.0582
Loa Loa (eye worm)	BEN-1 protein	0.0328	0.6934	1
Brugia malayi	hypothetical protein	0.008	0.1037	0.1495
Echinococcus multilocularis	tubulin alpha chain	0.0232	0.4653	0.6357
Brugia malayi	Animal haem peroxidase family protein	0.008	0.1037	0.1495
Loa Loa (eye worm)	tubulin beta-1 chain	0.0328	0.6934	1
Echinococcus multilocularis	carboxylesterase 5A	0.0164	0.3033	0.377
Echinococcus multilocularis	acetylcholinesterase	0.0164	0.3033	0.377
Trypanosoma cruzi	beta tubulin, putative	0.0328	0.6934	1
Schistosoma mansoni	patched 1	0.0064	0.0672	0.097
Schistosoma mansoni	tubulin subunit beta	0.0328	0.6934	1
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Echinococcus multilocularis	tubulin alpha chain	0.0232	0.4653	0.6357
Echinococcus granulosus	Tubulin alpha 1 chain	0.0232	0.4653	0.6357
Trichomonas vaginalis	tubulin gamma chain, putative	0.0074	0.0908	0.0376
Trypanosoma brucei	alpha tubulin, putative	0.0097	0.1442	0.0887
Mycobacterium ulcerans	hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase	0.0156	0.2855	1
Trichomonas vaginalis	tubulin alpha chain, putative	0.0171	0.3206	0.4046
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0053	0.0396	0.0571
Schistosoma mansoni	peroxidasin	0.008	0.1037	0.1495
Echinococcus granulosus	tubulin alpha chain	0.0232	0.4653	0.6357
Leishmania major	beta tubulin	0.0328	0.6934	1
Trichomonas vaginalis	3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative	0.0073	0.0885	0.034
Leishmania major	beta tubulin	0.0328	0.6934	1
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Echinococcus multilocularis	tubulin epsilon chain	0.0171	0.3206	0.4046
Schistosoma mansoni	tubulin subunit beta	0.0328	0.6934	1
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Schistosoma mansoni	tubulin subunit gamma	0.0171	0.3206	0.4623
Brugia malayi	Hydroxymethylglutaryl-coenzyme A reductase family protein	0.0156	0.2855	0.4118
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Toxoplasma gondii	beta tubulin	0.0328	0.6934	1
Echinococcus multilocularis	tubulin alpha	0.0171	0.3206	0.4046
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Echinococcus granulosus	tubulin epsilon chain	0.0171	0.3206	0.4046
Mycobacterium leprae	cell division protein FtsZ	0.0074	0.0908	0.5
Trypanosoma brucei	epsilon tubulin	0.0171	0.3206	0.3813
Echinococcus granulosus	tubulin alpha	0.0171	0.3206	0.4046
Trypanosoma cruzi	epsilon tubulin, putative	0.0171	0.3206	0.3813
Trypanosoma brucei	tubulin gamma chain	0.0171	0.3206	0.3813
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Entamoeba histolytica	tubulin family protein	0.0328	0.6934	1
Leishmania major	beta tubulin	0.0328	0.6934	1
Plasmodium falciparum	tubulin gamma chain	0.0171	0.3206	0.3813
Trypanosoma brucei	beta tubulin	0.0171	0.3206	0.3813
Entamoeba histolytica	tubulin alpha chain, putative	0.0232	0.4653	0.3882
Mycobacterium tuberculosis	Cell division protein FtsZ	0.0074	0.0908	0.5
Trichomonas vaginalis	tubulin beta chain, putative	0.0232	0.4653	0.6357
Echinococcus granulosus	tubulin alpha 1C chain	0.0232	0.4653	0.6357
Trypanosoma cruzi	3-hydroxy-3-methylglutaryl-CoA reductase	0.0156	0.2855	0.3231
Trichomonas vaginalis	tubulin alpha chain, putative	0.0097	0.1442	0.123
Echinococcus granulosus	tubulin beta 1 chain	0.0328	0.6934	1
Brugia malayi	Tubulin alpha-2 chain	0.0232	0.4653	0.671
Echinococcus granulosus	tubulin subunit beta	0.0328	0.6934	1
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0396	0.0571
Trichomonas vaginalis	tubulin, putative	0.0328	0.6934	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0232	0.4653	0.6357
Leishmania major	beta tubulin	0.0328	0.6934	1
Loa Loa (eye worm)	blistered cuticle protein 3	0.008	0.1037	0.1495
Echinococcus granulosus	tubulin alpha 3 chain	0.0232	0.4653	0.6357
Trichomonas vaginalis	conserved hypothetical protein	0.0074	0.0908	0.0376
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Trichomonas vaginalis	tubulin, putative	0.0074	0.0908	0.0376
Loa Loa (eye worm)	alpha-tubulin	0.0232	0.4653	0.671
Echinococcus granulosus	tubulin alpha chain	0.0232	0.4653	0.6357
Echinococcus granulosus	tubulin alpha chain	0.0232	0.4653	0.6357
Echinococcus multilocularis	geminin	0.0179	0.3397	0.4352
Plasmodium falciparum	alpha tubulin 2	0.0232	0.4653	0.6215
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Echinococcus multilocularis	Tubulin beta 2C chain	0.0328	0.6934	1
Plasmodium vivax	tubulin beta chain, putative	0.0328	0.6934	1
Schistosoma mansoni	hypothetical protein	0.0179	0.3397	0.4899
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0232	0.4653	0.671
Loa Loa (eye worm)	hypothetical protein	0.0164	0.3033	0.4374
Toxoplasma gondii	alpha-tubulin I, putative	0.0232	0.4653	0.6215
Loa Loa (eye worm)	tubulin alpha-3 chain	0.0135	0.2355	0.3397
Brugia malayi	beta-tubulin, identical	0.0328	0.6934	1
Leishmania major	beta tubulin	0.0328	0.6934	1
Brugia malayi	Carboxylesterase family protein	0.0164	0.3033	0.4374
Loa Loa (eye worm)	hypothetical protein	0.0135	0.2355	0.3397
Loa Loa (eye worm)	tubulin beta-2A chain	0.0328	0.6934	1
Echinococcus multilocularis	tubulin subunit beta	0.0328	0.6934	1
Brugia malayi	Tubulin alpha chain	0.0232	0.4653	0.671
Loa Loa (eye worm)	hypothetical protein	0.0164	0.3033	0.4374
Trypanosoma brucei	epsilon tubulin	0.0171	0.3206	0.3813
Leishmania major	beta tubulin	0.0328	0.6934	1
Echinococcus granulosus	beta tubulin	0.0328	0.6934	1
Trypanosoma brucei	3-hydroxy-3-methylglutaryl-CoA reductase, putative	0.0156	0.2855	0.3231
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0672	0.097
Giardia lamblia	Alpha-tubulin	0.0232	0.4653	0.6229
Echinococcus multilocularis	tubulin alpha chain	0.0232	0.4653	0.6357
Echinococcus granulosus	Tubulin beta 2C chain	0.0328	0.6934	1
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Loa Loa (eye worm)	acetylcholinesterase 1	0.0164	0.3033	0.4374
Brugia malayi	Animal haem peroxidase family protein	0.008	0.1037	0.1495
Echinococcus multilocularis	tubulin alpha 1C chain	0.0232	0.4653	0.6357
Entamoeba histolytica	tubulin alpha-1 chain	0.0232	0.4653	0.3882
Echinococcus granulosus	alpha tubulin	0.0232	0.4653	0.6357
Schistosoma mansoni	tubulin subunit alpha	0.0232	0.4653	0.671
Trypanosoma brucei	alpha tubulin	0.0232	0.4653	0.6215
Echinococcus granulosus	tubulin gamma 1 chain	0.0171	0.3206	0.4046
Trichomonas vaginalis	tubulin gamma chain, putative	0.0171	0.3206	0.4046
Leishmania major	beta tubulin	0.0328	0.6934	1
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Loa Loa (eye worm)	tubulin gamma chain	0.0171	0.3206	0.4623
Trichomonas vaginalis	conserved hypothetical protein	0.0074	0.0908	0.0376
Loa Loa (eye worm)	BEN-1 protein	0.0328	0.6934	1
Schistosoma mansoni	tubulin subunit beta	0.0074	0.0908	0.1309
Echinococcus multilocularis	peroxisome assembly protein 26	0.0232	0.4653	0.6357
Echinococcus multilocularis	Tubulin beta 2C chain	0.0328	0.6934	1
Loa Loa (eye worm)	animal heme peroxidase	0.008	0.1037	0.1495
Schistosoma mansoni	tubulin subunit beta	0.0328	0.6934	1
Plasmodium falciparum	tubulin beta chain	0.0328	0.6934	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0232	0.4653	0.6357
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Loa Loa (eye worm)	animal heme peroxidase	0.008	0.1037	0.1495
Schistosoma mansoni	alpha tubulin	0.0232	0.4653	0.671
Trichomonas vaginalis	tubulin alpha chain, putative	0.0097	0.1442	0.123
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0232	0.4653	0.6357
Echinococcus multilocularis	hydroxymethylglutaryl coenzyme A reductase	0.0156	0.2855	0.3486
Echinococcus multilocularis	Tubulin beta 2C chain	0.0328	0.6934	1
Echinococcus multilocularis	tubulin alpha 3 chain	0.0232	0.4653	0.6357
Brugia malayi	Animal haem peroxidase family protein	0.008	0.1037	0.1495
Schistosoma mansoni	alpha tubulin	0.0232	0.4653	0.671
Leishmania major	beta tubulin	0.0328	0.6934	1
Echinococcus multilocularis	beta tubulin	0.0328	0.6934	1
Plasmodium vivax	tubulin gamma chain, putative	0.0171	0.3206	0.3813
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0158	0.289	0.3541
Trypanosoma brucei	beta tubulin	0.0328	0.6934	1
Schistosoma mansoni	tubulin subunit beta	0.0328	0.6934	1
Brugia malayi	Tubulin beta chain	0.0074	0.0908	0.1309
Plasmodium falciparum	tubulin epsilon chain, putative	0.0171	0.3206	0.3813
Onchocerca volvulus		0.016	0.2937	1
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Leishmania major	beta tubulin	0.0328	0.6934	1
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0328	0.6934	1
Schistosoma mansoni	hydroxymethylglutaryl-CoA reductase (NADPH)	0.0156	0.2855	0.4118
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0232	0.4653	0.6357
Loa Loa (eye worm)	beta-tubulin	0.0328	0.6934	1
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0171	0.3206	0.3813
Trichomonas vaginalis	tubulin beta chain, putative	0.0232	0.4653	0.6357
Brugia malayi	Animal haem peroxidase family protein	0.008	0.1037	0.1495
Schistosoma mansoni	tubulin subunit alpha	0.0232	0.4653	0.671
Trichomonas vaginalis	tubulin beta chain, putative	0.0232	0.4653	0.6357
Brugia malayi	Tubulin alpha chain	0.0074	0.0908	0.1309
Leishmania major	gamma-tubulin	0.0171	0.3206	0.3813
Loa Loa (eye worm)	tubulin alpha 2	0.0158	0.289	0.4168
Echinococcus granulosus	Tubulin beta 2C chain	0.0328	0.6934	1
Echinococcus granulosus	Tubulin beta 2C chain	0.0328	0.6934	1
Leishmania major	beta tubulin	0.0328	0.6934	1
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Schistosoma mansoni	hypothetical protein	0.0179	0.3397	0.4899
Schistosoma mansoni	tubulin subunit delta	0.0074	0.0908	0.1309
Leishmania major	beta tubulin	0.0328	0.6934	1
Plasmodium vivax	tubulin alpha chain, putative	0.0232	0.4653	0.6215
Loa Loa (eye worm)	hypothetical protein	0.016	0.2937	0.4235
Echinococcus granulosus	peroxisome assembly protein 26	0.0232	0.4653	0.6357
Echinococcus multilocularis	tubulin alpha chain	0.0232	0.4653	0.6357
Leishmania major	beta tubulin	0.0328	0.6934	1
Trichomonas vaginalis	tubulin, putative	0.0097	0.1442	0.123
Schistosoma mansoni	tubulin subunit beta	0.0328	0.6934	1
Onchocerca volvulus		0.0097	0.1442	0.2136
Brugia malayi	alpha-tubulin	0.0232	0.4653	0.671
Echinococcus multilocularis	tubulin alpha chain	0.0232	0.4653	0.6357
Brugia malayi	Tubulin gamma chain	0.0171	0.3206	0.4623
Schistosoma mansoni	tubulin subunit beta	0.0328	0.6934	1
Loa Loa (eye worm)	MH2 domain-containing protein	0.0126	0.2141	0.3087
Schistosoma mansoni	peroxidasin	0.008	0.1037	0.1495
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Schistosoma mansoni	alpha tubulin	0.0232	0.4653	0.671
Loa Loa (eye worm)	carboxylesterase	0.0164	0.3033	0.4374
Trichomonas vaginalis	tubulin alpha chain, putative	0.0097	0.1442	0.123
Leishmania major	beta tubulin	0.0328	0.6934	1
Loa Loa (eye worm)	alpha-tubulin isotype 2	0.0158	0.289	0.4168
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0232	0.4653	0.6357
Echinococcus multilocularis	tubulin alpha 1C chain	0.0232	0.4653	0.6357
Brugia malayi	Peroxidasin	0.008	0.1037	0.1495
Echinococcus granulosus	tubulin delta chain	0.0074	0.0908	0.0376
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0232	0.4653	0.6357
Trichomonas vaginalis	tubulin, putative	0.0097	0.1442	0.123
Giardia lamblia	Beta tubulin	0.0328	0.6934	1
Echinococcus multilocularis	tubulin subunit TubB	0.0232	0.4653	0.6357
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0064	0.0672	0.097
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0328	0.6934	1
Trichomonas vaginalis	tubulin gamma chain, putative	0.0171	0.3206	0.4046
Wolbachia endosymbiont of Brugia malayi	cell division protein FtsZ	0.0074	0.0908	0.5
Echinococcus multilocularis	tubulin delta chain	0.0074	0.0908	0.0376
Echinococcus granulosus	Tubulin beta 2C chain	0.0328	0.6934	1
Leishmania major	beta tubulin	0.0328	0.6934	1
Echinococcus multilocularis	hypothetical protein	0.0232	0.4653	0.6357
Brugia malayi	CHE-14 protein	0.0064	0.0672	0.097
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Echinococcus granulosus	Tubulin alpha 1 chain	0.0232	0.4653	0.6357
Trichomonas vaginalis	tubulin beta chain, putative	0.0328	0.6934	1
Echinococcus granulosus	hydroxymethylglutaryl coenzyme A reductase	0.0156	0.2855	0.3486
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0053	0.0396	0.0571
Brugia malayi	Carboxylesterase family protein	0.0164	0.3033	0.4374
Trichomonas vaginalis	tubulin alpha chain, putative	0.0328	0.6934	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0328	0.6934	1
Echinococcus granulosus	geminin	0.0179	0.3397	0.4352
Echinococcus granulosus	acetylcholinesterase	0.0164	0.3033	0.377
Toxoplasma gondii	beta-1 tubulin, putative	0.0328	0.6934	1
Giardia lamblia	Beta tubulin	0.0328	0.6934	1
Plasmodium falciparum	alpha tubulin 1	0.0232	0.4653	0.6215
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0328	0.6934	1
Loa Loa (eye worm)	animal heme peroxidase	0.008	0.1037	0.1495
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Leishmania major	epsilon tubulin, putative	0.0171	0.3206	0.3813
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Echinococcus granulosus	tubulin beta 4A class IVa	0.0328	0.6934	1
Trypanosoma cruzi	epsilon tubulin, putative	0.0171	0.3206	0.3813
Giardia lamblia	Gamma tubulin	0.0171	0.3206	0.3836
Brugia malayi	Tubulin beta chain	0.0097	0.1442	0.208
Echinococcus granulosus	tubulin alpha 3 chain	0.0232	0.4653	0.6357
Echinococcus granulosus	beta tubulin	0.0328	0.6934	1
Echinococcus multilocularis	acetylcholinesterase	0.0164	0.3033	0.377
Loa Loa (eye worm)	hypothetical protein	0.0156	0.2855	0.4118
Echinococcus multilocularis	tubulin beta 1 chain	0.0328	0.6934	1
Loa Loa (eye worm)	tubulin alpha chain	0.0232	0.4653	0.671
Brugia malayi	Animal haem peroxidase family protein	0.008	0.1037	0.1495
Echinococcus multilocularis	tubulin alpha 3 chain	0.0232	0.4653	0.6357
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0232	0.4653	0.6357
Schistosoma mansoni	tubulin subunit alpha	0.0074	0.0908	0.1309
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Trypanosoma brucei	beta tubulin	0.0328	0.6934	1
Trypanosoma brucei	epsilon tubulin	0.0171	0.3206	0.3813
Trypanosoma brucei	beta tubulin	0.0328	0.6934	1
Loa Loa (eye worm)	hypothetical protein	0.0232	0.4653	0.671
Trypanosoma cruzi	3-hydroxy-3-methylglutaryl-CoA reductase, putative	0.0156	0.2855	0.3231
Brugia malayi	tubulin alpha chain - mouse	0.0232	0.4653	0.671
Loa Loa (eye worm)	hypothetical protein	0.0158	0.289	0.4168
Echinococcus granulosus	tubulin alpha chain	0.0232	0.4653	0.6357
Trypanosoma brucei	alpha tubulin	0.0232	0.4653	0.6215
Echinococcus granulosus	tubulin subunit TubB	0.0232	0.4653	0.6357
Loa Loa (eye worm)	tubulin beta chain	0.0074	0.0908	0.1309
Echinococcus granulosus	peroxidasin	0.008	0.1037	0.0582
Loa Loa (eye worm)	tubulin alpha chain	0.0232	0.4653	0.671
Echinococcus granulosus	acetylcholinesterase	0.0164	0.3033	0.377
Trypanosoma brucei	alpha tubulin	0.0232	0.4653	0.6215
Trypanosoma brucei	alpha tubulin	0.0232	0.4653	0.6215
Trichomonas vaginalis	tubulin beta chain, putative	0.0232	0.4653	0.6357
Echinococcus multilocularis	beta tubulin	0.0328	0.6934	1
Plasmodium vivax	tubulin alpha chain, putative	0.0232	0.4653	0.6215
Echinococcus multilocularis	tubulin gamma 1 chain	0.0171	0.3206	0.4046
Giardia lamblia	Epsilon tubulin	0.0074	0.0908	0.0037
Giardia lamblia	Delta tubulin	0.0074	0.0908	0.0037
Plasmodium vivax	tubulin epsilon chain, putative	0.0171	0.3206	0.3813
Brugia malayi	MH2 domain containing protein	0.0126	0.2141	0.3087
Brugia malayi	Blistered cuticle protein 3	0.008	0.1037	0.1495
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0135	0.2355	0.2688
Loa Loa (eye worm)	tubulin beta chain	0.0328	0.6934	1
Brugia malayi	Tubulin beta-1 chain	0.0328	0.6934	1
Giardia lamblia	Alpha-tubulin	0.0232	0.4653	0.6229
Echinococcus granulosus	tubulin alpha chain	0.0232	0.4653	0.6357
Giardia lamblia	Beta tubulin	0.0328	0.6934	1
Leishmania major	beta tubulin	0.0328	0.6934	1
Trichomonas vaginalis	tubulin beta-1 chain, putative	0.0074	0.0908	0.0376
Loa Loa (eye worm)	animal heme peroxidase	0.008	0.1037	0.1495
Trichomonas vaginalis	tubulin gamma chain, putative	0.0328	0.6934	1
Echinococcus granulosus	carboxylesterase 5A	0.0164	0.3033	0.377
Brugia malayi	tubulin alpha-2 chain	0.0232	0.4653	0.671
Echinococcus granulosus	tubulin alpha 1C chain	0.0232	0.4653	0.6357
Echinococcus multilocularis	Tubulin beta 2C chain	0.0328	0.6934	1
Trichomonas vaginalis	3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative	0.0073	0.0885	0.034
Leishmania major	alpha tubulin	0.0232	0.4653	0.6215
Loa Loa (eye worm)	tubulin alpha 2	0.0061	0.0592	0.0854
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0064	0.0672	0.097
Leishmania major	beta tubulin	0.0328	0.6934	1
Echinococcus granulosus	Tubulin beta 2C chain	0.0328	0.6934	1
Toxoplasma gondii	beta-tubulin, putative	0.0328	0.6934	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0097	0.1442	0.123
Loa Loa (eye worm)	tubulin alpha 2	0.0158	0.289	0.4168
Loa Loa (eye worm)	hypothetical protein	0.008	0.1037	0.1495
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0074	0.0908	0.0376
Schistosoma mansoni	tubulin subunit alpha	0.0232	0.4653	0.671
Loa Loa (eye worm)	transcription factor SMAD2	0.0126	0.2141	0.3087
Trypanosoma cruzi	tubulin gamma chain	0.0171	0.3206	0.3813
Toxoplasma gondii	alpha tubulin TUBA1	0.0232	0.4653	0.6215
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0164	0.3033	0.4374
Leishmania major	beta tubulin	0.0328	0.6934	1
Loa Loa (eye worm)	tubulin beta-4 chain	0.0328	0.6934	1
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0232	0.4653	0.6357
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0053	0.0396	0.0571
Leishmania major	beta tubulin	0.0328	0.6934	1
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0097	0.1442	0.123
Brugia malayi	hypothetical protein	0.016	0.2937	0.4235
Loa Loa (eye worm)	alpha-tubulin	0.0232	0.4653	0.671
Leishmania major	3-hydroxy-3-methylglutaryl-CoA reductase	0.0156	0.2855	0.3231
Entamoeba histolytica	tubulin family protein	0.0328	0.6934	1
Trypanosoma brucei	beta tubulin	0.0328	0.6934	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.19 uM	Inhibition of electric eel AChE using acetylcholine iodide as substrate after 10 mins by Ellman method	ChEMBL.	23376249
IC50 (binding)	= 2.16 uM	Inhibition of equine serum BChE using butyrylthiocholine iodide as substrate after 10 mins by Ellman method	ChEMBL.	23376249

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: CHEMBL2337265

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1733737