TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 423.434 | Formula: C19H19F2N3O4S
H donors: 3 H acceptors: 4 LogP: 2.38 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CCCC1(C)NC(=O)c2c(NC1=O)ccc(c2)S(=O)(=O)Nc1ccc(cc1F)F
InChi: 1S/C19H19F2N3O4S/c1-3-8-19(2)18(26)22-15-7-5-12(10-13(15)17(25)23-19)29(27,28)24-16-6-4-11(20)9-14(16)21/h4-7,9-10,24H,3,8H2,1-2H3,(H,22,26)(H,23,25)
InChiKey: JZPFHHDKLDPOHW-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	mannosyl (alpha-1,6-)-glycoprotein beta-1,2-N-acetylglucosaminyltransferase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Brugia malayi	UDP-GlcNAc:a-6-D-mannoside b1,2-N-acetylglucosaminyltransferase II	Get druggable targets OG5_133242	All targets in OG5_133242
Echinococcus granulosus	alpha 16 mannosyl glycoprotein	Get druggable targets OG5_133242	All targets in OG5_133242
Schistosoma mansoni	beta-12-n-acetylglucosaminyltransferase II	Get druggable targets OG5_133242	All targets in OG5_133242
Schistosoma japonicum	ko:K00736 alpha-1,6-mannosyl-glycoprotein [EC2.4.1.143], putative	Get druggable targets OG5_133242	All targets in OG5_133242
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_133242	All targets in OG5_133242
Echinococcus multilocularis	alpha 1,6 mannosyl glycoprotein	Get druggable targets OG5_133242	All targets in OG5_133242

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
Brugia malayi	EGF-like domain containing protein	0.0009	0.0046	0.0089
Trichomonas vaginalis	rotamase, putative	0.0033	0.0345	0.9707
Echinococcus granulosus	neurogenic locus notch protein	0.0009	0.0046	0.0089
Brugia malayi	Isocitrate dehydrogenase	0.0016	0.0137	0.0264
Giardia lamblia	Heat shock protein HSP 90-alpha	0.0033	0.0344	1
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Schistosoma mansoni	beta-12-n-acetylglucosaminyltransferase II	0.0433	0.5188	1
Mycobacterium ulcerans	heat shock protein 90	0.0026	0.0262	1
Onchocerca volvulus	Heat shock protein 75 kDa, mitochondrial homolog	0.0014	0.0106	0.357
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0033	0.0345	1
Onchocerca volvulus	Peroxidase homolog	0.0027	0.0267	0.8975
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Onchocerca volvulus	Peroxidase homolog	0.0027	0.0267	0.8975
Echinococcus granulosus	lipoxygenase domain containing protein	0.002	0.0185	0.0357
Loa Loa (eye worm)	notch protein	0.0009	0.0046	0.0089
Plasmodium falciparum	LCCL domain-containing protein	0.002	0.0185	0.5053
Trypanosoma brucei	PAB1-binding protein , putative	0.0026	0.0254	0.715
Echinococcus granulosus	protein jagged 2	0.0009	0.0046	0.0089
Onchocerca volvulus	Bile acid receptor homolog	0.001	0.0066	0.2229
Loa Loa (eye worm)	hypothetical protein	0.001	0.0066	0.0128
Entamoeba histolytica	90 kDa heat shock protein, putative	0.0014	0.0106	0.2577
Schistosoma mansoni	laminin gamma-3 chain	0.0009	0.0046	0.0089
Brugia malayi	Animal haem peroxidase family protein	0.0027	0.0267	0.0514
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0066	0.0128
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.0016	0.0137	0.3547
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.001	0.0066	0.0128
Onchocerca volvulus	Peroxidasin homolog	0.0027	0.0267	0.8975
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.001	0.0066	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0056	0.0616	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.001	0.0066	0.0128
Onchocerca volvulus		0.0027	0.0267	0.8975
Schistosoma mansoni	steroid hormone receptor ad4bp	0.001	0.0066	0.0128
Brugia malayi	Calcium binding EGF domain containing protein	0.0009	0.0046	0.0089
Onchocerca volvulus		0.002	0.0185	0.6234
Loa Loa (eye worm)	hypothetical protein	0.001	0.0066	0.0128
Loa Loa (eye worm)	blistered cuticle protein 3	0.0027	0.0267	0.0514
Schistosoma mansoni	coup transcription factor	0.001	0.0066	0.0128
Onchocerca volvulus		0.002	0.0185	0.6234
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0005	0.0007	0.0014
Onchocerca volvulus		0.0027	0.0267	0.8975
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0016	0.0137	0.3531
Brugia malayi	F/Y-rich N-terminus family protein	0.0009	0.005	0.0096
Brugia malayi	nuclear hormone receptor	0.001	0.0066	0.0128
Echinococcus multilocularis	expressed protein	0.0034	0.0355	0.0355
Onchocerca volvulus	Dual oxidase homolog	0.0027	0.0267	0.8975
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0066	0.0128
Trypanosoma brucei	heat shock protein, putative	0.0033	0.0344	0.9957
Echinococcus granulosus	dnaJ subfamily B	0.0419	0.5015	0.9666
Brugia malayi	heat shock protein 90	0.0033	0.0344	0.0663
Trichomonas vaginalis	heat shock protein, putative	0.0014	0.0106	0.2533
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0066	0.0066
Trichomonas vaginalis	receptor histidine kinase, putative	0.0007	0.0023	0.0042
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase, putative	0.001	0.0067	0.136
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Brugia malayi	Doublecortin family protein	0.002	0.0185	0.0357
Schistosoma mansoni	Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)]	0.0009	0.0046	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0005	0.0007	0.0014
Brugia malayi	Hsp90 protein	0.0014	0.0106	0.0204
Giardia lamblia	Grp94/Hsp90	0.0026	0.0262	0.7443
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.001	0.0066	0.0066
Echinococcus granulosus	neurogenic locus protein delta	0.0009	0.0046	0.0089
Echinococcus multilocularis	RUN	0.002	0.0185	0.0185
Loa Loa (eye worm)	hypothetical protein	0.0005	0.0007	0.0014
Echinococcus multilocularis	isocitrate dehydrogenase	0.0016	0.0137	0.0137
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0012	0.0081	0.0081
Onchocerca volvulus		0.0009	0.0046	0.1552
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.001	0.0066	0.0066
Trichomonas vaginalis	heat shock protein, putative	0.0026	0.0262	0.7205
Schistosoma mansoni	cpg binding protein	0.0031	0.0317	0.0612
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.001	0.0066	0.0128
Echinococcus multilocularis	lipoxygenase domain containing protein	0.002	0.0185	0.0185
Brugia malayi	EGF-like domain containing protein	0.0009	0.0046	0.0089
Trypanosoma cruzi	heat shock protein 90, putative	0.0033	0.0344	0.9957
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0121	0.1403	0.2703
Brugia malayi	isocitrate dehydrogenase	0.0016	0.0137	0.0264
Onchocerca volvulus	Protein ultraspiracle homolog	0.001	0.0066	0.2229
Loa Loa (eye worm)	TOPoisomerase family member	0.0007	0.0023	0.0044
Loa Loa (eye worm)	hypothetical protein	0.002	0.0185	0.0357
Trichomonas vaginalis	heat shock protein, putative	0.0026	0.0262	0.7205
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Schistosoma mansoni	heat shock protein	0.0033	0.0344	0.0663
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.001	0.0066	0.0128
Schistosoma mansoni	hypothetical protein	0.0009	0.0046	0.0089
Trypanosoma cruzi	heat shock protein 85, putative	0.0033	0.0344	0.9957
Schistosoma mansoni	hypothetical protein	0.0009	0.0046	0.0089
Schistosoma mansoni	hypothetical protein	0.002	0.0185	0.0357
Schistosoma mansoni	polycystin 1-related	0.002	0.0185	0.0357
Chlamydia trachomatis	DNA gyrase subunit B	0.0007	0.0023	0.5
Onchocerca volvulus		0.0029	0.0297	1
Trichomonas vaginalis	sensor histidine kinase, putative	0.0007	0.0023	0.0042
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0016	0.0137	0.3531
Schistosoma mansoni	cpg binding protein	0.0031	0.0317	0.0612
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0033	0.0345	1
Echinococcus granulosus	geminin	0.0173	0.2043	0.3938
Loa Loa (eye worm)	hypothetical protein	0.0153	0.1794	0.3458
Plasmodium vivax	endoplasmin, putative	0.0033	0.0344	1
Loa Loa (eye worm)	hypothetical protein	0.0005	0.0007	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0121	0.1403	0.1403
Echinococcus granulosus	neural cadherin	0.0009	0.0046	0.0089
Schistosoma mansoni	hypothetical protein	0.0009	0.0046	0.0089
Schistosoma mansoni	slit	0.0009	0.0046	0.0089
Brugia malayi	Animal haem peroxidase family protein	0.0027	0.0267	0.0514
Schistosoma mansoni	notch	0.0009	0.0046	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Trypanosoma cruzi	heat shock protein 90, putative	0.002	0.0179	0.4834
Trichomonas vaginalis	endoplasmin, putative	0.002	0.0188	0.4994
Brugia malayi	ecdysteroid receptor	0.001	0.0066	0.0128
Echinococcus multilocularis	heat shock protein	0.0033	0.0344	0.0344
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0016	0.0137	0.3531
Schistosoma mansoni	hypothetical protein	0.0012	0.0081	0.0156
Echinococcus granulosus	neurogenic locus notch protein 4	0.0009	0.0046	0.0089
Loa Loa (eye worm)	hypothetical protein	0.002	0.0185	0.0357
Brugia malayi	steroid hormone receptor	0.001	0.0066	0.0128
Entamoeba histolytica	heat shock protein 90, putative	0.0033	0.0344	0.9957
Echinococcus multilocularis	neurogenic locus notch protein	0.0009	0.0046	0.0046
Brugia malayi	UDP-GlcNAc:a-6-D-mannoside b1,2-N-acetylglucosaminyltransferase II	0.0433	0.5188	1
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Echinococcus granulosus	lipoxygenase domain containing protein	0.002	0.0185	0.0357
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0007	0.0029	0.0029
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0016	0.0137	0.0264
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.001	0.0066	0.0128
Brugia malayi	Endoplasmin precursor	0.0033	0.0344	0.0663
Echinococcus multilocularis	ecdysone induced protein 78C	0.001	0.0066	0.0066
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.001	0.0067	0.136
Schistosoma mansoni	rab6-interacting	0.002	0.0185	0.0357
Echinococcus multilocularis	heat shock protein 75 kDa, mitochondrial	0.0014	0.0106	0.0106
Onchocerca volvulus	Putative cubilin	0.0009	0.0046	0.1552
Schistosoma mansoni	rab6-interacting	0.002	0.0185	0.0357
Brugia malayi	Nuclear hormone receptor-like 1	0.001	0.0066	0.0128
Plasmodium falciparum	heat shock protein 90, putative	0.0014	0.0106	0.2588
Echinococcus multilocularis	muscleblind protein 1	0.0153	0.1794	0.1794
Brugia malayi	DNA topoisomerase II, alpha isozyme	0.0007	0.0023	0.0044
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0066	0.0128
Toxoplasma gondii	Hsp90 domain-containing protein	0.0014	0.0106	0.1402
Trypanosoma brucei	Heat shock protein 83, putative	0.0033	0.0344	0.9957
Onchocerca volvulus	Slit protein homolog	0.0009	0.0046	0.1552
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Brugia malayi	EGF-like domain containing protein	0.0009	0.0046	0.0089
Schistosoma mansoni	hypothetical protein	0.0419	0.5015	0.9666
Echinococcus granulosus	protein jagged 1	0.0009	0.0046	0.0089
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.001	0.0066	0.0128
Trichomonas vaginalis	heat shock protein, putative	0.0033	0.0344	0.9666
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Schistosoma mansoni	thyroid hormone receptor	0.001	0.0066	0.0128
Echinococcus granulosus	muscleblind protein	0.0153	0.1794	0.3458
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0007	0.0029	0.0029
Brugia malayi	Blistered cuticle protein 3	0.0027	0.0267	0.0514
Echinococcus multilocularis	slit 2 protein	0.0009	0.0046	0.0046
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.001	0.0066	0.0128
Loa Loa (eye worm)	heat shock protein 90	0.0033	0.0344	0.0663
Schistosoma mansoni	endoplasmin	0.0033	0.0344	0.0663
Echinococcus multilocularis	Polycystic kidney disease protein	0.002	0.0185	0.0185
Loa Loa (eye worm)	animal heme peroxidase	0.0027	0.0267	0.0514
Echinococcus multilocularis	muscleblind protein	0.0153	0.1794	0.1794
Onchocerca volvulus		0.0027	0.0267	0.8975
Echinococcus granulosus	neurogenic locus notch protein	0.0009	0.0046	0.0089
Echinococcus multilocularis	fibropellin Ia	0.0009	0.0046	0.0046
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.001	0.0067	0.136
Mycobacterium tuberculosis	Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G)	0.0026	0.0262	1
Brugia malayi	Cadherin domain containing protein	0.0009	0.0046	0.0089
Trypanosoma brucei	heat shock protein, putative	0.0033	0.0344	0.9957
Echinococcus granulosus	DNA topoisomerase 2 alpha	0.0007	0.0023	0.0044
Schistosoma mansoni	peroxidasin	0.0027	0.0267	0.0514
Brugia malayi	Animal haem peroxidase family protein	0.0027	0.0267	0.0514
Echinococcus multilocularis	peroxidasin	0.0027	0.0267	0.0267
Schistosoma mansoni	heat shock protein	0.0014	0.0106	0.0204
Schistosoma mansoni	notch	0.0009	0.0046	0.0089
Plasmodium falciparum	heat shock protein 90	0.0033	0.0344	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0066	0.0128
Leishmania major	heat shock protein, putative	0.0014	0.0106	0.2577
Brugia malayi	EGF-like domain containing protein	0.0009	0.0046	0.0089
Echinococcus multilocularis	protein jagged 1	0.0009	0.0046	0.0046
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0016	0.0137	0.3531
Brugia malayi	hypothetical protein	0.0005	0.0007	0.0014
Trichomonas vaginalis	receptor histidine kinase, putative	0.0007	0.0023	0.0042
Echinococcus granulosus	cpg binding protein	0.0031	0.0317	0.0612
Trypanosoma brucei	heat shock protein, putative	0.0033	0.0344	0.9957
Schistosoma mansoni	retinoic acid receptor RXR	0.001	0.0066	0.0128
Brugia malayi	photoreceptor-specific nuclear receptor	0.001	0.0066	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.001	0.0066	0.0128
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0051	0.0051
Echinococcus multilocularis	alpha 1,6 mannosyl glycoprotein	0.0433	0.5188	0.5188
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0137	0.0137
Echinococcus multilocularis	protein jagged 2	0.0009	0.0046	0.0046
Toxoplasma gondii	heat shock protein HSP90	0.0033	0.0344	0.5416
Toxoplasma gondii	heat shock protein 75, putative	0.0014	0.0106	0.1402
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0066	0.0128
Onchocerca volvulus		0.0009	0.0046	0.1552
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.001	0.0066	0.0128
Echinococcus granulosus	heat shock protein 90	0.0033	0.0344	0.0663
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.001	0.0066	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, putative	0.0033	0.0345	1
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0007	0.0023	0.0773
Schistosoma mansoni	hypothetical protein	0.0173	0.2043	0.3938
Toxoplasma gondii	heat shock protein 90, putative	0.0033	0.0344	0.5416
Leishmania major	peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative	0.0033	0.0345	1
Brugia malayi	Muscle positioning protein 4	0.0009	0.0046	0.0089
Brugia malayi	DNA gyrase/topoisomerase IV, A subunit family protein	0.0007	0.0023	0.0044
Toxoplasma gondii	EGF family domain-containing protein	0.0009	0.0046	0.039
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Toxoplasma gondii	isocitrate dehydrogenase	0.0016	0.0137	0.1921
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Treponema pallidum	heat shock protein 90	0.0026	0.0262	1
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Brugia malayi	nuclear receptor RXR	0.0005	0.0007	0.0014
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0005	0.0007	0.0014
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0005	0.0007	0.0014
Giardia lamblia	High cysteine protein	0.0009	0.0046	0.0721
Echinococcus granulosus	fibropellin Ia	0.0009	0.0046	0.0089
Schistosoma mansoni	cell polarity protein	0.0009	0.0046	0.0089
Echinococcus multilocularis	cpg binding protein	0.0031	0.0317	0.0317
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0016	0.0137	0.0137
Echinococcus granulosus	protein jagged 1	0.0009	0.0046	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0005	0.0007	0.0014
Echinococcus granulosus	slit 2 protein	0.0009	0.0046	0.0089
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.001	0.0066	0.0128
Plasmodium vivax	heat shock protein 90, putative	0.0014	0.0106	0.2588
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Brugia malayi	Delta serrate ligand family protein	0.0009	0.0046	0.0089
Echinococcus multilocularis	dnaJ subfamily B	0.0419	0.5015	0.5015
Echinococcus multilocularis	Pyruvate dehydrogenase (lipoamide) kinase	0.0007	0.0023	0.0023
Loa Loa (eye worm)	hypothetical protein	0.0007	0.0023	0.0044
Echinococcus granulosus	alpha 16 mannosyl glycoprotein	0.0433	0.5188	1
Echinococcus granulosus	heat shock protein 75 kDa mitochondrial	0.0014	0.0106	0.0204
Schistosoma mansoni	septate junction protein	0.0009	0.0046	0.0089
Brugia malayi	Animal haem peroxidase family protein	0.0027	0.0267	0.0514
Chlamydia trachomatis	DNA gyrase subunit B	0.0007	0.0023	0.5
Brugia malayi	Animal haem peroxidase family protein	0.0027	0.0267	0.0514
Echinococcus multilocularis	neurogenic locus protein delta	0.0009	0.0046	0.0046
Onchocerca volvulus	Neurogenic locus notch homolog	0.0009	0.0046	0.1552
Echinococcus multilocularis	geminin	0.0173	0.2043	0.2043
Trypanosoma brucei	heat shock protein, putative	0.0033	0.0344	0.9957
Brugia malayi	kinase, mitochondrial precursor	0.0007	0.0023	0.0044
Echinococcus multilocularis	protein jagged 1	0.0009	0.0046	0.0046
Echinococcus multilocularis	neural cadherin	0.0009	0.0046	0.0046
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Echinococcus granulosus	Pyruvate dehydrogenase lipoamide kinase	0.0007	0.0023	0.0044
Schistosoma mansoni	RAR-like nuclear receptor	0.001	0.0066	0.0128
Trypanosoma cruzi	heat shock protein 90, putative	0.0026	0.0262	0.7411
Schistosoma mansoni	pyruvate dehydrogenase	0.0007	0.0023	0.0044
Schistosoma mansoni	heat shock protein	0.0033	0.0344	0.0663
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Echinococcus multilocularis	DNA topoisomerase 2 alpha	0.0007	0.0023	0.0023
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0016	0.0137	0.3547
Echinococcus granulosus	peroxidasin	0.0027	0.0267	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.001	0.0066	0.0128
Schistosoma mansoni	lipoxygenase	0.0084	0.0963	0.1856
Toxoplasma gondii	isocitrate dehydrogenase	0.0016	0.0137	0.1921
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0005	0.0007	0.0007
Brugia malayi	Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1	0.0034	0.0355	0.0685
Onchocerca volvulus	Chorion peroxidase homolog	0.0027	0.0267	0.8975
Loa Loa (eye worm)	doublecortin family protein	0.002	0.0185	0.0357
Loa Loa (eye worm)	steroid hormone receptor	0.001	0.0066	0.0128
Schistosoma mansoni	notch	0.0009	0.0046	0.0089
Echinococcus multilocularis	notch	0.0009	0.0046	0.0046
Trypanosoma brucei	heat shock protein, putative	0.0033	0.0344	0.9957
Schistosoma mansoni	lipoxygenase	0.0121	0.1403	0.2703
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0066	0.0128
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0029	0.0297	0.0573
Loa Loa (eye worm)	hypothetical protein	0.0007	0.0023	0.0044
Echinococcus multilocularis	neurogenic locus notch protein	0.0009	0.0046	0.0046
Echinococcus multilocularis	heat shock protein 90	0.0033	0.0344	0.0344
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.001	0.0066	0.0128
Schistosoma mansoni	thyroid hormone receptor	0.001	0.0066	0.0128
Trichomonas vaginalis	heat shock protein, putative	0.002	0.0188	0.4994
Mycobacterium leprae	PROBABLE CHAPERONE PROTEIN HTPG (HEAT SHOCK PROTEIN) (HSP90 FAMILY PROTEIN) (HIGH TEMPERATURE PROTEIN G)	0.0026	0.0262	1
Echinococcus multilocularis	fat cadherin tumor suppressor	0.0009	0.0046	0.0046
Echinococcus multilocularis	neurogenic locus protein delta	0.0009	0.0046	0.0046
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.001	0.0066	0.0066
Onchocerca volvulus		0.0009	0.0046	0.1552
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.001	0.0066	0.0128
Brugia malayi	notch-like transmembrane receptor	0.0009	0.0046	0.0089
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0016	0.0137	0.0264
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.001	0.0066	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0153	0.1794	0.3458
Trypanosoma cruzi	PAB1-binding protein , putative	0.0026	0.0254	0.715
Trypanosoma cruzi	heat shock protein 85, putative	0.0033	0.0344	0.9957
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase/rotamase, putative	0.0033	0.0345	1
Trichomonas vaginalis	mismatch repair protein Mlh1C (mutL homolog)	0.0007	0.0023	0.0042
Brugia malayi	hypothetical protein	0.0027	0.0267	0.0514
Echinococcus granulosus	heat shock protein heat shock protein 90 alpha	0.0026	0.0262	0.0505
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Brugia malayi	Probable DNA topoisomerase II	0.0007	0.0023	0.0044
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Loa Loa (eye worm)	Pin1-type peptidyl-prolyl cis-trans isomerase	0.0034	0.0355	0.0685
Loa Loa (eye worm)	hypothetical protein	0.001	0.0066	0.0128
Toxoplasma gondii	PPIC-type PPIASE domain-containing protein	0.001	0.0067	0.074
Trichomonas vaginalis	rotamase, putative	0.0034	0.0355	1
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.001	0.0066	0.0128
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.001	0.0066	0.0128
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0005	0.0007	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Trichomonas vaginalis	DNA topoisomerase II, putative	0.0007	0.0023	0.0042
Echinococcus granulosus	FTZ F1 alpha	0.001	0.0066	0.0128
Echinococcus granulosus	heat shock protein	0.0033	0.0344	0.0663
Loa Loa (eye worm)	hypothetical protein	0.0005	0.0007	0.0014
Onchocerca volvulus		0.001	0.0066	0.2229
Echinococcus granulosus	endoplasmin	0.0026	0.0262	0.0505
Echinococcus granulosus	expressed protein	0.0034	0.0355	0.0685
Trypanosoma brucei	heat shock protein, putative	0.0033	0.0344	0.9957
Echinococcus multilocularis	heat shock protein 90	0.0026	0.0262	0.0262
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.001	0.0066	0.0128
Trypanosoma brucei	heat shock protein 90, putative	0.0033	0.0344	0.9957
Schistosoma mansoni	hypothetical protein	0.0009	0.0046	0.0089
Schistosoma mansoni	notch	0.0009	0.0046	0.0089
Brugia malayi	Nuclear hormone receptor-like 1	0.0005	0.0007	0.0014
Echinococcus granulosus	heat shock protein 90	0.0026	0.0262	0.0505
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Loa Loa (eye worm)	histone methyltransferase	0.0009	0.0051	0.0098
Leishmania major	hypothetical protein, conserved	0.0026	0.0254	0.715
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0137	0.0137
Echinococcus multilocularis	Pyruvate dehydrogenase (lipoamide) kinase	0.0007	0.0023	0.0023
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Echinococcus granulosus	notch	0.0009	0.0046	0.0089
Schistosoma mansoni	notch	0.0009	0.0046	0.0089
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0137	0.0137
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0016	0.0137	0.3531
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.001	0.0066	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0254	0.0489
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.001	0.0066	0.0066
Plasmodium vivax	heat shock protein, putative	0.0014	0.0106	0.2588
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0062	0.0697	0.1343
Schistosoma mansoni	peroxidasin	0.0027	0.0267	0.0514
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Toxoplasma gondii	peptidylprolyl isomerase	0.0033	0.0345	0.5439
Plasmodium falciparum	heat shock protein 90, putative	0.0014	0.0106	0.2588
Loa Loa (eye worm)	animal heme peroxidase	0.0027	0.0267	0.0514
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.001	0.0066	0.0128
Trypanosoma cruzi	Heat shock protein 83, putative	0.0033	0.0344	0.9957
Echinococcus multilocularis	neurogenic locus notch protein 4	0.0009	0.0046	0.0046
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Schistosoma mansoni	nuclear hormone receptor	0.001	0.0066	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Brugia malayi	Steroid receptor seven-up type 2	0.001	0.0066	0.0128
Loa Loa (eye worm)	animal heme peroxidase	0.0027	0.0267	0.0514
Schistosoma mansoni	hypothetical protein	0.0173	0.2043	0.3938
Schistosoma mansoni	endoplasmin	0.0033	0.0344	0.0663
Brugia malayi	Cadherin domain containing protein	0.0009	0.0046	0.0089
Plasmodium vivax	heat shock protein 86, putative	0.0033	0.0344	1
Leishmania major	lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative	0.0026	0.0262	0.7411
Trypanosoma brucei	heat shock protein 90, putative	0.0033	0.0344	0.9957
Loa Loa (eye worm)	hypothetical protein	0.001	0.0066	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0007	0.0023	0.0044
Echinococcus granulosus	Polycystic kidney disease protein	0.002	0.0185	0.0357
Brugia malayi	EGF-like domain containing protein	0.0009	0.0046	0.0089
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.001	0.0066	0.2229
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Brugia malayi	Nuclear hormone receptor-like 1	0.0005	0.0007	0.0014
Trypanosoma brucei	heat shock protein, putative	0.0033	0.0344	0.9957
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0066	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Schistosoma mansoni	hypothetical protein	0.0009	0.0046	0.0089
Brugia malayi	GCC2 and GCC3 family protein	0.0009	0.0046	0.0089
Brugia malayi	hypothetical protein	0.002	0.0185	0.0357
Trypanosoma brucei	heat shock protein, putative	0.0033	0.0344	0.9957
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0066	0.0128
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.001	0.0066	0.0128
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0012	0.0081	0.0156
Wolbachia endosymbiont of Brugia malayi	parvulin-like peptidyl-prolyl isomerase, PPID	0.001	0.0067	0.1836
Trypanosoma brucei	heat shock protein 84, putative	0.0014	0.0106	0.2577
Echinococcus granulosus	protein jagged 2	0.0009	0.0046	0.0089
Loa Loa (eye worm)	heat shock protein 75	0.0014	0.0106	0.0204
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.001	0.0066	0.0128
Toxoplasma gondii	LsmAD domain-containing protein	0.0026	0.0254	0.3889
Plasmodium vivax	multidomain scavenger receptor, putative	0.002	0.0185	0.5053
Plasmodium falciparum	endoplasmin, putative	0.002	0.0188	0.5145
Brugia malayi	nuclear receptor NHR-88	0.001	0.0066	0.0128
Schistosoma mansoni	DNA topoisomerase II	0.0007	0.0023	0.0044
Loa Loa (eye worm)	hypothetical protein	0.001	0.0066	0.0128
Brugia malayi	Transmembrane cell adhesion receptor mua-3 precursor, putative	0.0009	0.0046	0.0089
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0066	0.0066
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0016	0.0137	0.4765
Giardia lamblia	Heat shock protein HSP 90-alpha	0.0026	0.0262	0.7443
Brugia malayi	Peroxidasin	0.0027	0.0267	0.0514
Brugia malayi	hypothetical protein	0.0005	0.0007	0.0014
Brugia malayi	hypothetical protein	0.002	0.0185	0.0357
Schistosoma mansoni	loxhd1	0.002	0.0185	0.0357
Leishmania major	heat shock protein 83-1	0.0033	0.0344	0.9957
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0007	0.0029	0.0057
Brugia malayi	Calcium binding EGF domain containing protein	0.0009	0.0046	0.0089
Echinococcus multilocularis	FTZ F1 alpha	0.001	0.0066	0.0066
Trichomonas vaginalis	sensory transduction histidine kinase bacterial, putative	0.0007	0.0023	0.0042
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Loa Loa (eye worm)	hypothetical protein	0.001	0.0066	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Brugia malayi	EGF-like domain containing protein	0.0009	0.0046	0.0089
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.001	0.0066	0.0128
Onchocerca volvulus		0.0009	0.0046	0.1552
Onchocerca volvulus	Peroxidasin homolog	0.0027	0.0267	0.8975
Echinococcus granulosus	RUN	0.002	0.0185	0.0357
Loa Loa (eye worm)	hypothetical protein	0.0433	0.5188	1
Trichomonas vaginalis	sensory transduction histidine kinase, putative	0.0007	0.0023	0.0042
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Trypanosoma cruzi	heat shock protein 85, putative	0.0033	0.0344	0.9957
Echinococcus multilocularis	lipoxygenase domain containing protein	0.002	0.0185	0.0185
Onchocerca volvulus	Neurogenic locus notch protein homolog	0.0009	0.0046	0.1552
Loa Loa (eye worm)	hypothetical protein	0.001	0.0066	0.0128
Loa Loa (eye worm)	hypothetical protein	0.001	0.0066	0.0128
Onchocerca volvulus		0.0009	0.0046	0.1552
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0267	0.0514
Schistosoma mansoni	notch	0.0009	0.0046	0.0089
Trichomonas vaginalis	sensory transduction histidine kinase bacterial, putative	0.0007	0.0023	0.0042
Chlamydia trachomatis	two component regulatory system sensor histidine kinase	0.0007	0.0023	0.5
Schistosoma mansoni	rotamase	0.0034	0.0355	0.0685
Trypanosoma cruzi	heat shock protein, putative	0.0014	0.0106	0.2577
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Trypanosoma cruzi	PAB1-binding protein , putative	0.0026	0.0254	0.715
Plasmodium vivax	ataxin-2 like protein, putative	0.0026	0.0254	0.7181
Echinococcus multilocularis	endoplasmin	0.0026	0.0262	0.0262
Brugia malayi	Muscleblind-like protein	0.0153	0.1794	0.3458
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.001	0.0066	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0016	0.0137	0.0264
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0007	0.0029	0.0057
Echinococcus multilocularis	thyroid hormone receptor alpha	0.001	0.0066	0.0066
Wolbachia endosymbiont of Brugia malayi	heat shock protein 90	0.0026	0.0262	1
Onchocerca volvulus	Putative DNA topoisomerase 2, mitochondrial	0.0007	0.0023	0.0773
Loa Loa (eye worm)	endoplasmin	0.0033	0.0344	0.0663
Brugia malayi	CXXC zinc finger family protein	0.0029	0.0297	0.0573
Entamoeba histolytica	heat shock protein 90, putative	0.0033	0.0344	0.9957
Plasmodium falciparum	ataxin-2 like protein, putative	0.0026	0.0254	0.7181
Trichomonas vaginalis	two component sensor and regulator histidine kinase bacteria, putative	0.0007	0.0023	0.0042
Schistosoma mansoni	hypothetical protein	0.0009	0.0046	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Brugia malayi	EGF-like domain containing protein	0.0009	0.0046	0.0089
Echinococcus granulosus	delta-like protein 1	0.0009	0.0046	0.0089
Trypanosoma cruzi	heat shock protein 85, putative	0.0026	0.0262	0.7411
Trichomonas vaginalis	heat shock protein, putative	0.0026	0.0262	0.7205
Leishmania major	peptidyl-prolyl cis-trans isomerase, putative	0.001	0.0067	0.136
Plasmodium falciparum	ataxin-2 like protein, putative	0.0026	0.0254	0.7181
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0046	0.0089
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0007	0.0029	0.0057
Brugia malayi	Calcium binding EGF domain containing protein	0.0009	0.0046	0.0089
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0355	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0051	0.0098
Schistosoma mansoni	cpg binding protein	0.0029	0.0297	0.0573
Brugia malayi	hypothetical protein	0.0017	0.0143	0.0275
Echinococcus granulosus	ecdysone induced protein 78C	0.001	0.0066	0.0128
Loa Loa (eye worm)	Notch2	0.0009	0.0046	0.0089
Loa Loa (eye worm)	animal heme peroxidase	0.0027	0.0267	0.0514
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0007	0.0023	0.0773
Brugia malayi	hypothetical protein	0.0026	0.0254	0.0489
Schistosoma mansoni	hypothetical protein	0.0009	0.0046	0.0089

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 7.3	Inhibition of human recombinant MGAT2 expressed in insect cell membrane using 2-oleoyl-sn-glycerol and oleoyl coenzyme A as substrate after 40 mins by Ellmans assay based rapidfire LCMS analysis	ChEMBL.	23541669

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: CHEMBL2376307

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1765995