TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 402.424 | Formula: C18H18N4O5S
H donors: 2 H acceptors: 4 LogP: 1.74 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: CC(O/C(=C/1\C(=Nc2n(C1c1cccc(c1)[N+](=O)[O-])c(=S)[nH]c(=O)c2)C)/O)C
InChi: 1S/C18H18N4O5S/c1-9(2)27-17(24)15-10(3)19-13-8-14(23)20-18(28)21(13)16(15)11-5-4-6-12(7-11)22(25)26/h4-9,16,24H,1-3H3,(H,20,23,28)/b17-15+
InChiKey: CUGWHLMDECMHTQ-BMRADRMJSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	multiple endocrine neoplasia I		No references
Mus musculus	RAR-related orphan receptor gamma	Starlite/ChEMBL	No references
Influenza A virus	Nonstructural protein 1	Starlite/ChEMBL	No references
Trypanosoma brucei gambiense	ATP-dependent phosphofructokinase,6-phospho-1-fructokinase		No references
Bacillus subtilis	4'-phosphopantetheinyl transferase ffp	Starlite/ChEMBL	No references
Homo sapiens	survival of motor neuron 2, centromeric	Starlite/ChEMBL	No references
Homo sapiens	euchromatic histone-lysine N-methyltransferase 2	Starlite/ChEMBL	No references
Trypanosoma brucei	ATP-dependent 6-phosphofructokinase, glycosomal	Starlite/ChEMBL	No references
Homo sapiens	lamin A/C	Starlite/ChEMBL	No references
Homo sapiens	lysine (K)-specific methyltransferase 2A	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	6-phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Echinococcus multilocularis	dnaJ subfamily B	Get druggable targets OG5_133913	All targets in OG5_133913
Trypanosoma cruzi	ATP-dependent 6-phosphofructokinase, glycosomal	Get druggable targets OG5_126758	All targets in OG5_126758
Onchocerca volvulus		Get druggable targets OG5_128723	All targets in OG5_128723
Cryptosporidium hominis	proteinx0005	Get druggable targets OG5_129301	All targets in OG5_129301
Leishmania braziliensis	ATP-dependent phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Schistosoma japonicum	ko:K07611 lamin, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Leishmania mexicana	6-phospho-1-fructokinase, putative	Get druggable targets OG5_126758	All targets in OG5_126758
Loa Loa (eye worm)	phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Entamoeba histolytica	phosphofructokinase, putative	Get druggable targets OG5_126758	All targets in OG5_126758
Leishmania donovani	ATP-dependent 6-phosphofructokinase, glycosomal	Get druggable targets OG5_126758	All targets in OG5_126758
Schistosoma japonicum	expressed protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	ko:K00850 6-phosphofructokinase [EC2.7.1.11], putative	Get druggable targets OG5_126758	All targets in OG5_126758
Echinococcus granulosus	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Candida albicans	phosphofructokinase beta-subunit that can functionally substitute for S. cerevisiae PFK2 (YMR205C)	Get druggable targets OG5_126758	All targets in OG5_126758
Brugia malayi	Pre-SET motif family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Schistosoma mansoni	intermediate filament proteins	Get druggable targets OG5_128723	All targets in OG5_128723
Brugia malayi	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	mixed-lineage leukemia protein mll	Get druggable targets OG5_130642	All targets in OG5_130642
Neospora caninum	Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a	Get druggable targets OG5_130642	All targets in OG5_130642
Candida albicans	phosphofructokinase alpha subunit that can functionally substitute for S. cerevisiae PFK1 (YGR240C)	Get druggable targets OG5_126758	All targets in OG5_126758
Candida albicans	phosphofructokinase alpha subunit that can functionally substitute for S. cerevisiae PFK1 (YGR240C)	Get druggable targets OG5_126758	All targets in OG5_126758
Echinococcus granulosus	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	6-phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Echinococcus granulosus	6 phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Onchocerca volvulus		Get druggable targets OG5_129301	All targets in OG5_129301
Brugia malayi	hypothetical protein	Get druggable targets OG5_132873	All targets in OG5_132873
Candida albicans	hypothetical protein	Get druggable targets OG5_126758	All targets in OG5_126758
Schistosoma japonicum	expressed protein	Get druggable targets OG5_128723	All targets in OG5_128723
Trypanosoma brucei	ATP-dependent 6-phosphofructokinase, glycosomal	Get druggable targets OG5_126758	All targets in OG5_126758
Loa Loa (eye worm)	6-phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Echinococcus granulosus	L aminoadipate semialdehyde	Get druggable targets OG5_129301	All targets in OG5_129301
Entamoeba histolytica	phosphofructokinase, putative	Get druggable targets OG5_126758	All targets in OG5_126758
Entamoeba histolytica	phosphofructokinase, putative	Get druggable targets OG5_126758	All targets in OG5_126758
Trichomonas vaginalis	phosphofructokinase, putative	Get druggable targets OG5_126758	All targets in OG5_126758
Echinococcus granulosus	cytoplasmic intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Onchocerca volvulus		Get druggable targets OG5_131470	All targets in OG5_131470
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	Get druggable targets OG5_129301	All targets in OG5_129301
Echinococcus multilocularis	cytoplasmic intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	hypothetical protein	Get druggable targets OG5_133913	All targets in OG5_133913
Echinococcus multilocularis	6 phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Schistosoma mansoni	6-phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Cryptosporidium parvum	phosphopantetheinyl transferase	Get druggable targets OG5_129301	All targets in OG5_129301
Echinococcus multilocularis	survival motor neuron protein 1	Get druggable targets OG5_132873	All targets in OG5_132873
Echinococcus multilocularis	lamin dm0	Get druggable targets OG5_128723	All targets in OG5_128723
Trypanosoma congolense	ATP-dependent 6-phosphofructokinase, glycosomal	Get druggable targets OG5_126758	All targets in OG5_126758
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132873	All targets in OG5_132873
Trichomonas vaginalis	phosphofructokinase, putative	Get druggable targets OG5_126758	All targets in OG5_126758
Echinococcus granulosus	survival motor neuron protein 1	Get druggable targets OG5_132873	All targets in OG5_132873
Trypanosoma brucei gambiense	ATP-dependent phosphofructokinase,6-phospho-1-fructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	Get druggable targets OG5_129301	All targets in OG5_129301
Trichomonas vaginalis	phosphofructokinase, putative	Get druggable targets OG5_126758	All targets in OG5_126758
Echinococcus multilocularis	musashi	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	lamin dm0	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Leishmania major	ATP-dependent phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Brugia malayi	phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Onchocerca volvulus		Get druggable targets OG5_128723	All targets in OG5_128723
Trichomonas vaginalis	set domain proteins, putative	Get druggable targets OG5_131470	All targets in OG5_131470
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	Get druggable targets OG5_126758	All targets in OG5_126758
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Schistosoma japonicum	Menin, putative	Get druggable targets OG5_133913	All targets in OG5_133913
Echinococcus granulosus	dnaJ subfamily B	Get druggable targets OG5_133913	All targets in OG5_133913
Brugia malayi	6-phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Toxoplasma gondii	histone lysine methyltransferase SET1	Get druggable targets OG5_130642	All targets in OG5_130642
Mycobacterium ulcerans	6-phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Leishmania infantum	ATP-dependent phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758
Schistosoma japonicum	Lamin-C, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Brugia malayi	Intermediate filament tail domain containing protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	ko:K00142 aminoadipate-semialdehyde dehydrogenase [EC1.2.1.31], putative	Get druggable targets OG5_129301	All targets in OG5_129301
Schistosoma japonicum	ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative	Get druggable targets OG5_130642	All targets in OG5_130642
Schistosoma mansoni	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_129301	All targets in OG5_129301
Mycobacterium leprae	PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE)	Get druggable targets OG5_126758	All targets in OG5_126758
Trichomonas vaginalis	phosphofructokinase, putative	Get druggable targets OG5_126758	All targets in OG5_126758
Mycobacterium tuberculosis	Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase)	Get druggable targets OG5_126758	All targets in OG5_126758
Candida albicans	phosphofructokinase beta-subunit that can functionally substitute for S. cerevisiae PFK2 (YMR205C)	Get druggable targets OG5_126758	All targets in OG5_126758
Schistosoma japonicum	Intermediate filament protein ifa-1, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	L aminoadipate semialdehyde	Get druggable targets OG5_129301	All targets in OG5_129301
Schistosoma japonicum	expressed protein	Get druggable targets OG5_129301	All targets in OG5_129301
Brugia malayi	6-phosphofructokinase	Get druggable targets OG5_126758	All targets in OG5_126758

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Candida albicans	aminoadipate-semialdehyde dehydrogenase small subunit	4'-phosphopantetheinyl transferase ffp	224 aa	183 aa	27.3 %
Entamoeba histolytica	hypothetical protein	4'-phosphopantetheinyl transferase ffp	224 aa	198 aa	28.3 %
Mycobacterium tuberculosis	Hypothetical protein	Nonstructural protein 1	230 aa	202 aa	23.8 %
Trichomonas vaginalis	conserved hypothetical protein	4'-phosphopantetheinyl transferase ffp	224 aa	197 aa	22.3 %
Onchocerca volvulus		4'-phosphopantetheinyl transferase ffp	224 aa	186 aa	26.3 %
Candida albicans	aminoadipate-semialdehyde dehydrogenase small subunit	4'-phosphopantetheinyl transferase ffp	224 aa	183 aa	27.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0597	0.2697	0.266
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0331	0.1461	0.1417
Trichomonas vaginalis	phosphofructokinase, putative	0.0131	0.053	0.0449
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0331	0.1461	0.1388
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0156	0.0643	0.012
Schistosoma mansoni	hypothetical protein	0.0494	0.2217	0.2162
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1616	0.7437	0.7415
Loa Loa (eye worm)	hypothetical protein	0.0268	0.1165	0.1165
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0424	0.189	0.189
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0512	0.23	0.23
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0738	0.3352	0.3296
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1178	0.5399	0.536
Trypanosoma cruzi	phosphatidylinositol kinase, putative	0.0156	0.0643	0.012
Loa Loa (eye worm)	phosphatidylinositol 3	0.0156	0.0643	0.0643
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1727	0.7954	0.7936
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.1222	0.5604	0.5573
Onchocerca volvulus		0.0156	0.0643	0.4846
Plasmodium vivax	phosphatidylinositol 3- and 4-kinase, putative	0.0156	0.0643	0.6874
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0331	0.1461	0.0983
Loa Loa (eye worm)	6-phosphofructokinase	0.0131	0.053	0.053
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0715	0.3244	0.3187
Loa Loa (eye worm)	hypothetical protein	0.0438	0.1957	0.1957
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.0214	0.0913	1
Loa Loa (eye worm)	hypothetical protein	0.01	0.0386	0.0386
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0214	0.0913	0.0849
Trichomonas vaginalis	phosphofructokinase, putative	0.0131	0.053	0.0449
Toxoplasma gondii	phosphofructokinase PFKII	0.0035	0.0084	0.0045
Echinococcus multilocularis	6 phosphofructokinase	0.0131	0.053	0.0462
Brugia malayi	CXXC zinc finger family protein	0.0035	0.008	0.008
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0037	0.009	0.002
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0156	0.0643	0.0803
Toxoplasma gondii	target of rapamycin (TOR), putative	0.1616	0.7437	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1616	0.7437	0.7415
Plasmodium vivax	hypothetical protein	0.0156	0.0643	0.6874
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0252	0.1092	0.1092
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0214	0.0913	0.0405
Onchocerca volvulus		0.0156	0.0643	0.4846
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0033	0.007	0.007
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1616	0.7437	0.7415
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0214	0.0913	0.0913
Echinococcus granulosus	L aminoadipate semialdehyde	0.01	0.0386	0.0318
Onchocerca volvulus		0.0058	0.019	0.101
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.0424	0.189	0.1832
Entamoeba histolytica	phosphatidylinositol 3-kinase 3, putative	0.0156	0.0643	0.0596
Entamoeba histolytica	hypothetical protein	0.0156	0.0643	0.0596
Schistosoma mansoni	6-phosphofructokinase	0.0131	0.053	0.0462
Entamoeba histolytica	hypothetical protein	0.0424	0.189	0.1849
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0131	0.053	1
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0738	0.3352	0.3319
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.2167	1	1
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0156	0.0643	0.0596
Trichomonas vaginalis	conserved hypothetical protein	0.047	0.2106	0.2039
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0035	0.0084	0.0389
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0738	0.3352	0.3352
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0715	0.3244	0.2866
Leishmania major	hypothetical protein, conserved	0.0156	0.0643	0.0596
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.0424	0.189	0.1832
Plasmodium falciparum	phosphatidylinositol 3- and 4-kinase, putative	0.0156	0.0643	0.6874
Loa Loa (eye worm)	phosphofructokinase	0.0131	0.053	0.053
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.2167	1	1
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0156	0.0643	0.012
Loa Loa (eye worm)	hypothetical protein	0.047	0.2106	0.2106
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0156	0.0643	0.0564
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1616	0.7437	0.7415
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1459	0.6707	0.6679
Echinococcus granulosus	DNA dependent protein kinase catalytic subunit	0.0156	0.0643	0.0577
Leishmania major	phosphatidylinositol kinase, putative	0.0156	0.0643	0.0596
Loa Loa (eye worm)	hypothetical protein	0.0512	0.23	0.23
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1727	0.7954	0.7936
Leishmania major	phosphatidylinositol 4-kinase, putative	0.0156	0.0643	0.0596
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0507	0.2279	0.2279
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0156	0.0643	0.0577
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0037	0.009	0.002
Loa Loa (eye worm)	hypothetical protein	0.0424	0.189	0.189
Entamoeba histolytica	hypothetical protein	0.0156	0.0643	0.0596
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0268	0.1165	0.1091
Schistosoma mansoni	phosphatidylinositol 3-kinase class	0.0156	0.0643	0.0577
Schistosoma mansoni	hypothetical protein	0.0156	0.0643	0.0577
Plasmodium vivax	SET domain protein, putative	0.0037	0.009	0.0462
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0037	0.009	0.0054
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0214	0.0913	0.0836
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.1729	0.7962	0.7951
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0331	0.1461	0.14
Brugia malayi	phosphofructokinase	0.0131	0.053	0.053
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2167	1	1
Giardia lamblia	Phosphatidylinositol 4-kinase	0.0156	0.0643	0.0564
Onchocerca volvulus		0.0037	0.009	0.0167
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1302	0.5975	0.5941
Loa Loa (eye worm)	phosphatidylinositol 3	0.0738	0.3352	0.3352
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0156	0.0643	0.0643
Loa Loa (eye worm)	hypothetical protein	0.0314	0.1381	0.1381
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.2167	1	1
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.0314	0.1381	0.132
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0214	0.0913	0.1168
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1727	0.7954	0.7936
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0738	0.3352	0.3319
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0214	0.0913	0.0849
Schistosoma mansoni	hypothetical protein	0.0058	0.019	0.012
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.091	0.4152	0.4123
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0331	0.1461	0.1388
Mycobacterium leprae	PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE)	0.0131	0.053	0.8079
Echinococcus multilocularis	cpg binding protein	0.0037	0.0089	0.0019
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.1034	0.4728	0.4702
Loa Loa (eye worm)	hypothetical protein	0.0156	0.0643	0.0643
Entamoeba histolytica	phosphatidylinositol 4-kinase, putative	0.0214	0.0913	0.0867
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0156	0.0643	0.0643
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0176	0.0736	0.0218
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0214	0.0913	0.0405
Entamoeba histolytica	phosphofructokinase, putative	0.0131	0.053	0.0482
Wolbachia endosymbiont of Brugia malayi	4'-phosphopantetheinyl transferase	0.0028	0.005	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1413	0.6491	0.6461
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0037	0.009	0.002
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0738	0.3352	0.2981
Entamoeba histolytica	phosphofructokinase, putative	0.0131	0.053	0.0482
Brugia malayi	FAT domain containing protein	0.0314	0.1381	0.1381
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0738	0.3352	0.3305
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.2167	1	1
Schistosoma mansoni	cpg binding protein	0.0037	0.0089	0.0019
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0075	0.0267	0.0198
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.2167	1	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0037	0.009	0.002
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1727	0.7954	0.7936
Brugia malayi	Pre-SET motif family protein	0.0252	0.1092	0.1092
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1176	0.5391	0.5352
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0067	0.0231	0.0244
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0331	0.1461	0.1461
Trichomonas vaginalis	phosphofructokinase, putative	0.0131	0.053	0.0449
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0214	0.0913	0.0849
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0715	0.3244	0.321
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0156	0.0643	1
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0268	0.1165	0.0671
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0214	0.0913	0.1168
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.0314	0.1381	0.132
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2167	1	1
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0534	0.2405	0.234
Loa Loa (eye worm)	phosphatidylinositol kinase	0.0156	0.0643	0.0643
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0035	0.008	0.008
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0738	0.3352	0.2981
Echinococcus granulosus	histone lysine methyltransferase setb	0.0037	0.009	0.002
Schistosoma mansoni	hypothetical protein	0.0314	0.1381	0.132
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1178	0.5399	0.536
Schistosoma mansoni	cpg binding protein	0.0035	0.008	0.001
Loa Loa (eye worm)	phosphatidylinositol 3	0.0156	0.0643	0.0643
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0424	0.189	0.189
Entamoeba histolytica	hypothetical protein	0.0156	0.0643	0.0596
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0156	0.0643	0.0577
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0035	0.008	0.001
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0214	0.0913	0.0867
Plasmodium vivax	hypothetical protein, conserved	0.0156	0.0643	0.6874
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0156	0.0643	0.0564
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0738	0.3352	0.3319
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0559	0.2519	0.2481
Trypanosoma brucei	phosphatidylinositol 3-kinase catalytic subunit, putative	0.0156	0.0643	0.0596
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0156	0.0643	0.6874
Entamoeba histolytica	pyrophosphate-dependent phosphofructokinase	0.0035	0.0084	0.0034
Loa Loa (eye worm)	hypothetical protein	0.0203	0.0863	0.0863
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.2167	1	1
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0424	0.189	0.1436
Onchocerca volvulus		0.0035	0.008	0.0083
Leishmania major	phosphatidylinositol kinase related protein, putative	0.0156	0.0643	0.0596
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1176	0.5391	0.5352
Schistosoma mansoni	survival motor neuron protein	0.0058	0.019	0.012
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0738	0.3352	0.3296
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0214	0.0913	0.0867
Onchocerca volvulus		0.0287	0.1253	1
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0214	0.0913	0.0836
Loa Loa (eye worm)	hypothetical protein	0.0037	0.009	0.009
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.2167	1	1
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0035	0.0084	0.0701
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0424	0.189	0.1832
Echinococcus multilocularis	survival motor neuron protein 1	0.0286	0.1247	0.1185
Entamoeba histolytica	phosphofructokinase, putative	0.0131	0.053	0.0482
Brugia malayi	intermediate filament protein	0.0033	0.007	0.007
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0738	0.3352	0.3296
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.2167	1	1
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0068	0.0068
Leishmania major	hypothetical protein, unknown function	0.0156	0.0643	0.0596
Trypanosoma brucei	ATP-dependent 6-phosphofructokinase, glycosomal	0.0131	0.053	0.0482
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1178	0.5399	0.536
Entamoeba histolytica	phosphatidylinositol-4,5-bisphosphate 3-kinase, putative	0.0214	0.0913	0.0867
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1302	0.5975	0.5941
Echinococcus multilocularis	dnaJ subfamily B	0.0494	0.2217	0.2162
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1176	0.5391	0.5352
Brugia malayi	hypothetical protein	0.0286	0.1247	0.1247
Giardia lamblia	GTOR	0.2167	1	1
Loa Loa (eye worm)	hypothetical protein	0.0286	0.1247	0.1247
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0156	0.0643	0.6874
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0424	0.189	0.1821
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0156	0.0643	0.0564
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0715	0.3244	0.3187
Trichomonas vaginalis	phosphofructokinase, putative	0.0131	0.053	0.0449
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0156	0.0643	0.0803
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.1729	0.7962	0.7951
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0156	0.0643	0.012
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.2167	1	1
Echinococcus multilocularis	Zinc finger, PHD finger	0.0214	0.0913	0.0849
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0331	0.1461	0.1417
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0331	0.1461	0.1417
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0156	0.0643	0.0577
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0058	0.019	0.019
Loa Loa (eye worm)	phosphatidylinositol 3	0.2167	1	1
Plasmodium vivax	6-phosphofructokinase, putative	0.0035	0.0084	0.0389
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1616	0.7437	0.7415
Giardia lamblia	Hypothetical protein	0.0156	0.0643	0.0564
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0156	0.0643	0.0564
Mycobacterium leprae	conserved hypothetical protein	0.0156	0.0643	1
Trypanosoma cruzi	target of rapamycin kinase 3	0.1729	0.7962	0.7848
Brugia malayi	Pre-SET motif family protein	0.0037	0.009	0.009
Schistosoma mansoni	cpg binding protein	0.0037	0.0089	0.0019
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0512	0.23	0.2245
Loa Loa (eye worm)	phosphatidylinositol 3	0.0156	0.0643	0.0643
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0037	0.009	0.002
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0156	0.0643	0.0577
Leishmania major	ATP-dependent phosphofructokinase	0.0131	0.053	0.0482
Trichomonas vaginalis	conserved hypothetical protein	0.0314	0.1381	0.1308
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	0.01	0.0386	0.0386
Echinococcus granulosus	serine protein kinase ATM	0.0424	0.189	0.1832
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.1222	0.5604	0.5573
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0424	0.189	0.1849
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0512	0.23	0.2245
Echinococcus granulosus	phosphatidylinositol 4 kinase beta	0.0156	0.0643	0.0577
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1616	0.7437	0.7415
Schistosoma mansoni	6-phosphofructokinase	0.0131	0.053	0.0462
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.2167	1	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.0156	0.0643	0.0643
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1289	0.5915	0.5881
Mycobacterium ulcerans	6-phosphofructokinase	0.0131	0.053	1
Trichomonas vaginalis	set domain proteins, putative	0.0287	0.1253	0.1179
Echinococcus multilocularis	serine protein kinase ATM	0.0424	0.189	0.1832
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0417	0.1857	0.1788
Brugia malayi	6-phosphofructokinase	0.0131	0.053	0.053
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1178	0.5399	0.536
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0156	0.0643	0.0643
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0424	0.189	0.1821
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0214	0.0913	0.0913
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.047	0.2106	0.2783
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1302	0.5975	0.5941
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0424	0.189	0.1821
Brugia malayi	Intermediate filament tail domain containing protein	0.0033	0.007	0.007
Echinococcus multilocularis		0.0156	0.0643	0.0577
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0331	0.1461	0.1388
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0214	0.0913	0.0849
Mycobacterium tuberculosis	Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase)	0.0131	0.053	0.8079
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	0.01	0.0386	0.0318
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0037	0.009	0.002
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0738	0.3352	0.3319
Echinococcus granulosus	cpg binding protein	0.0037	0.0089	0.0019
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0738	0.3352	0.3296
Echinococcus granulosus	6 phosphofructokinase	0.0131	0.053	0.0462
Loa Loa (eye worm)	phosphatidylinositol 3	0.1104	0.5057	0.5057
Echinococcus multilocularis	L aminoadipate semialdehyde	0.01	0.0386	0.0318
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0594	0.2682	0.262
Brugia malayi	6-phosphofructokinase	0.0131	0.053	0.053
Entamoeba histolytica	hypothetical protein	0.0597	0.2697	0.266
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.2167	1	1
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0534	0.2405	0.234
Plasmodium falciparum	phosphatidylinositol 4-kinase	0.0156	0.0643	0.6874
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0738	0.3352	0.3305
Plasmodium vivax	6-phosphofructokinase, putative	0.0035	0.0084	0.0389
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0156	0.0643	0.012
Loa Loa (eye worm)	intermediate filament protein	0.0033	0.007	0.007
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0424	0.189	0.1436
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1289	0.5915	0.5881
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0738	0.3352	0.3296
Toxoplasma gondii	phosphofructokinase domain-containing protein	0.0035	0.0084	0.0045
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0156	0.0643	0.0803
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0035	0.0084	0.0389
Schistosoma mansoni	fkbp-rapamycin associated protein	0.0424	0.189	0.1832
Onchocerca volvulus		0.01	0.0386	0.2668
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0715	0.3244	0.3187
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.0424	0.189	0.1849
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0394	0.1752	0.1711
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.0156	0.0643	0.0577
Toxoplasma gondii	6-phosphofructokinase	0.0035	0.0084	0.0045
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0035	0.0084	1
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0035	0.0084	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0715	0.3244	0.3244
Loa Loa (eye worm)	hypothetical protein	0.0033	0.007	0.007
Echinococcus granulosus	survival motor neuron protein 1	0.0286	0.1247	0.1185
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0738	0.3352	0.3305
Giardia lamblia	Phosphoinositide-3-kinase, class 3	0.0273	0.1191	0.1116
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2167	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0268	0.1165	0.1091
Loa Loa (eye worm)	6-phosphofructokinase	0.0131	0.053	0.053
Schistosoma mansoni	phosphatidylinositol 4-kinase type-II	0.0156	0.0643	0.0577
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0214	0.0913	0.0836
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0214	0.0913	0.0867
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1853	0.8538	0.8525
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.0214	0.0913	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.0176	0.0736	0.0736
Entamoeba histolytica	protein kinase rad3, putative	0.0424	0.189	0.1849
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0715	0.3244	0.2866
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.1222	0.5604	0.5573
Toxoplasma gondii	FATC domain-containing protein	0.0424	0.189	0.249
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1616	0.7437	0.7415
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1727	0.7954	0.7936
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0214	0.0913	0.0849
Echinococcus granulosus	dnaJ subfamily B	0.0494	0.2217	0.2162
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0156	0.0643	0.0577

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 0.0032 um	PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 0.0224 um	PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	3.3808 uM	PUBCHEM_BIOASSAY: qHTS Assay to Find Inhibitors of T. brucei phosphofructokinase. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488768, AID492961]	ChEMBL.	No reference
Potency (functional)	3.5481 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404]	ChEMBL.	No reference
Potency (functional)	= 11.2202 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 11.2202 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 12.5893 um	PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 17.7828 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	22.3872 uM	PubChem BioAssay. qHTS for Inhibitors of Glutaminase (GLS). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 28.1838 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of 12-hLO (12-human lipoxygenase). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 28.1838 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))]	ChEMBL.	No reference
Potency (functional)	= 35.4813 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of Human alpha-Glucosidase Cleavage of Glycogen. (Class of assay: confirmatory) [Related pubchem assays: 1473, 1466 ]	ChEMBL.	No reference
Potency (functional)	50.1187 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402]	ChEMBL.	No reference
Potency (functional)	50.1187 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771]	ChEMBL.	No reference
Potency (functional)	52.1194 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of mutant isocitrate dehydrogenase 1 (IDH1): qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL1995383

Bibliographic References

No literature references available for this target.

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

Detailed information for compound 1629174