TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 434.532 | Formula: C19H22N4O4S2
H donors: 1 H acceptors: 4 LogP: 1.82 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: O=C(C1CC(=O)N(C1)c1ccccc1C)Nc1nnc(s1)SCCC1OCCO1
InChi: 1S/C19H22N4O4S2/c1-12-4-2-3-5-14(12)23-11-13(10-15(23)24)17(25)20-18-21-22-19(29-18)28-9-6-16-26-7-8-27-16/h2-5,13,16H,6-11H2,1H3,(H,20,21,25)
InChiKey: XFOPLWUFAFTFLB-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	polymerase (DNA directed), eta	Starlite/ChEMBL	No references
Homo sapiens	polymerase (DNA directed) iota	Starlite/ChEMBL	No references
Homo sapiens	polymerase (DNA directed), beta	Starlite/ChEMBL	No references
Homo sapiens	multiple endocrine neoplasia I		No references
Homo sapiens	lysine (K)-specific methyltransferase 2A	Starlite/ChEMBL	No references
Homo sapiens	phosphatidylinositol-5-phosphate 4-kinase, type II, alpha	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus granulosus	phosphatidylinositol 5 phosphate 4 kinase type 2	Get druggable targets OG5_131617	All targets in OG5_131617
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128521	All targets in OG5_128521
Toxoplasma gondii	histone lysine methyltransferase SET1	Get druggable targets OG5_130642	All targets in OG5_130642
Trypanosoma congolense	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Schistosoma japonicum	ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative	Get druggable targets OG5_130642	All targets in OG5_130642
Leishmania mexicana	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Schistosoma japonicum	ko:K00889 1-phosphatidylinositol-4-phosphate 5-kinase [EC2.7.1.68], putative	Get druggable targets OG5_131617	All targets in OG5_131617
Schistosoma mansoni	phosphatidylinositol-4-phosphate 5-kinase type II	Get druggable targets OG5_131617	All targets in OG5_131617
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131617	All targets in OG5_131617
Leishmania major	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Schistosoma japonicum	ko:K03509 DNA polymerase eta subunit, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Trypanosoma cruzi	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Candida albicans	similar to S. cerevisiae DNA polymerase pol-eta, involved in the bypass of distorted DNA lesions	Get druggable targets OG5_128521	All targets in OG5_128521
Leishmania braziliensis	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Leishmania braziliensis	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Schistosoma japonicum	ko:K03509 DNA polymerase eta subunit, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Echinococcus multilocularis	phosphatidylinositol 5 phosphate 4 kinase type 2	Get druggable targets OG5_131617	All targets in OG5_131617
Leishmania braziliensis	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	Get druggable targets OG5_130965	All targets in OG5_130965
Trypanosoma brucei gambiense	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Neospora caninum	Pc21g17280 protein, related	Get druggable targets OG5_128521	All targets in OG5_128521
Brugia malayi	ImpB/MucB/SamB family protein	Get druggable targets OG5_128521	All targets in OG5_128521
Candida albicans	similar to S. cerevisiae DNA polymerase pol-eta, involved in the bypass of distorted DNA lesions	Get druggable targets OG5_128521	All targets in OG5_128521
Schistosoma japonicum	Menin, putative	Get druggable targets OG5_133913	All targets in OG5_133913
Leishmania infantum	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Cryptosporidium parvum	DinB/family X-type DNA polymerase	Get druggable targets OG5_128521	All targets in OG5_128521
Trypanosoma congolense	mitochondrial DNA polymerase beta, putative	Get druggable targets OG5_130965	All targets in OG5_130965
Trypanosoma brucei gambiense	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Echinococcus granulosus	dnaJ subfamily B	Get druggable targets OG5_133913	All targets in OG5_133913
Brugia malayi	Pip kinase protein 2	Get druggable targets OG5_131617	All targets in OG5_131617
Leishmania mexicana		Get druggable targets OG5_128521	All targets in OG5_128521
Schistosoma mansoni	mixed-lineage leukemia protein mll	Get druggable targets OG5_130642	All targets in OG5_130642
Echinococcus granulosus	dna polymerase eta	Get druggable targets OG5_128521	All targets in OG5_128521
Schistosoma mansoni	DNA polymerase eta	Get druggable targets OG5_128521	All targets in OG5_128521
Mycobacterium ulcerans	hypothetical protein	Get druggable targets OG5_130965	All targets in OG5_130965
Mycobacterium tuberculosis	Conserved hypothetical protein	Get druggable targets OG5_130965	All targets in OG5_130965
Schistosoma mansoni	phosphatidylinositol-4-phosphate 5-kinase type II	Get druggable targets OG5_131617	All targets in OG5_131617
Leishmania major	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Schistosoma mansoni	hypothetical protein	Get druggable targets OG5_133913	All targets in OG5_133913
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	Get druggable targets OG5_130965	All targets in OG5_130965
Leishmania major	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Echinococcus multilocularis	dna polymerase eta	Get druggable targets OG5_128521	All targets in OG5_128521
Leishmania infantum	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Leishmania infantum	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Trypanosoma brucei	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
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
Trypanosoma cruzi	DNA polymerase eta, putative	Get druggable targets OG5_128521	All targets in OG5_128521
Leishmania donovani	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Loa Loa (eye worm)	pip kinase 2	Get druggable targets OG5_131617	All targets in OG5_131617
Onchocerca volvulus		Get druggable targets OG5_131617	All targets in OG5_131617
Echinococcus multilocularis	dnaJ subfamily B	Get druggable targets OG5_133913	All targets in OG5_133913
Leishmania mexicana	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Trypanosoma brucei	mitochondrial DNA polymerase beta	Get druggable targets OG5_130965	All targets in OG5_130965
Toxoplasma gondii	ImpB/MucB/SamB family protein	Get druggable targets OG5_128521	All targets in OG5_128521

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trypanosoma brucei	phosphatidylinositol phosphate kinase alpha	phosphatidylinositol-5-phosphate 4-kinase, type II, alpha	406 aa	341 aa	32.0 %
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	polymerase (DNA directed), beta	335 aa	303 aa	32.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0943	0.2467
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0015	0.0065	0.0068
Schistosoma mansoni	hypothetical protein	0.0494	1	1
Trypanosoma cruzi	phosphatidylinositol-4-phosphate 5-kinase-like, putative	0.0016	0.0074	0.0037
Trypanosoma brucei	DNA polymerase IV, putative	0.0047	0.0714	0.0918
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0015	0.0065	0.0018
Toxoplasma gondii	hypothetical protein	0.0015	0.0065	0.0164
Loa Loa (eye worm)	pip kinase 2	0.0196	0.3821	1
Giardia lamblia	Phosphatidylinositol-4-phosphate 5-kinase, putative	0.0016	0.0074	0.0401
Loa Loa (eye worm)	pip kinase 1	0.0016	0.0074	0.0193
Brugia malayi	FYVE finger-containing phosphoinositide kinase, putative	0.0016	0.0074	0.0093
Toxoplasma gondii	hypothetical protein	0.0059	0.0968	0.8657
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0365	0.7318	1
Leishmania major	mitochondrial DNA polymerase beta	0.0365	0.7318	1
Trypanosoma brucei	DNA polymerase eta, putative	0.0077	0.1353	0.1796
Echinococcus multilocularis	musashi	0.0026	0.0292	0.0282
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0282	0.0738
Echinococcus multilocularis	voltage dependent calcium channel subunit	0.013	0.2448	0.244
Loa Loa (eye worm)	FYVE zinc finger family protein	0.0016	0.0074	0.0193
Giardia lamblia	DINP protein human, muc B family	0.0047	0.0714	1
Trypanosoma brucei	phosphatidylinositol phosphate kinase alpha	0.0016	0.0074	0.0037
Trypanosoma cruzi	phosphatidylinositol-4-phosphate 5-kinase, putative	0.0016	0.0074	0.0037
Schistosoma mansoni	lamin	0.0026	0.0292	0.0246
Echinococcus granulosus	phosphatidylinositol phosphate 5 kinase type III	0.0016	0.0074	0.0064
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0065	0.0169
Toxoplasma gondii	phosphatidylinositol-4-phosphate 5-Kinase	0.0016	0.0074	0.0251
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0047	0.0714	1
Mycobacterium ulcerans	hypothetical protein	0.0192	0.3735	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0032	0.0414	0.0505
Trypanosoma brucei	DNA polymerase IV, putative	0.0047	0.0714	0.0918
Echinococcus multilocularis	lamin	0.0026	0.0292	0.0282
Loa Loa (eye worm)	Sodium:neurotransmitter symporter family protein	0.0015	0.0065	0.0169
Echinococcus granulosus	intermediate filament protein	0.0026	0.0292	0.0282
Trypanosoma brucei	mitochondrial DNA polymerase beta-PAK	0.0173	0.333	0.4515
Loa Loa (eye worm)	norepinephrine transporter	0.0015	0.0065	0.0169
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0015	0.0065	0.0068
Chlamydia trachomatis	Ssodium-dependent amino acid transporter	0.0015	0.0065	0.5
Loa Loa (eye worm)	FYVE finger-containing phosphoinositide kinase	0.0016	0.0074	0.0193
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0065	0.0169
Schistosoma mansoni	dihydropyridine-sensitive l-type calcium channel	0.0125	0.2338	0.2301
Onchocerca volvulus		0.0026	0.0292	0.0605
Echinococcus granulosus	voltage dependent calcium channel subunit	0.0286	0.5686	0.5681
Schistosoma mansoni	serine-rich repeat protein	0.0067	0.1142	0.11
Schistosoma mansoni	phosphatidylinositol-4-phosphate 5-kinase type I	0.0016	0.0074	0.0027
Echinococcus granulosus	uncharacterized sodium dependent transporter	0.0015	0.0065	0.0055
Trypanosoma brucei	unspecified product	0.0047	0.0714	0.0918
Trypanosoma cruzi	phosphatidylinositol (3,5) kinase, putative	0.0016	0.0074	0.0037
Loa Loa (eye worm)	hypothetical protein	0.0101	0.1845	0.4829
Leishmania major	DNA polymerase eta, putative	0.0077	0.1353	0.1796
Plasmodium falciparum	amino acid transporter, putative	0.0015	0.0065	0.6528
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Toxoplasma gondii	Sodium:neurotransmitter symporter family protein	0.0015	0.0065	0.0164
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0014	0.0039	0.0102
Loa Loa (eye worm)	intermediate filament protein	0.0026	0.0292	0.0764
Schistosoma mansoni	sodium/chloride dependent transporter	0.0015	0.0065	0.0018
Onchocerca volvulus		0.0196	0.3821	1
Echinococcus granulosus	Phosphatidylinositol 4 phosphate 5 kinase type 1	0.0016	0.0074	0.0064
Echinococcus granulosus	dna polymerase kappa	0.0047	0.0714	0.0705
Leishmania major	phosphatidylinositol-4-phosphate 5-kinase-like, putative	0.0016	0.0074	0.0037
Trypanosoma brucei	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0074	0.1274	0.1233
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0101	0.1845	0.1807
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0101	0.1845	0.1807
Leishmania major	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Loa Loa (eye worm)	hypothetical protein	0.0013	0.001	0.0026
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0047	0.0714	0.067
Schistosoma mansoni	cpg binding protein	0.0037	0.0508	0.0463
Trypanosoma cruzi	phosphatidylinositol-4-phosphate 5-kinase, putative	0.0016	0.0074	0.0037
Echinococcus multilocularis	serotonin transporter	0.0015	0.0065	0.0055
Leishmania major	mitochondrial DNA polymerase beta-PAK, putative	0.0173	0.333	0.4515
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0047	0.0714	0.067
Plasmodium falciparum	phosphatidylinositol-4-phosphate 5-kinase	0.0016	0.0074	1
Trypanosoma cruzi	phosphatidylinositol 4-phosphate 5-kinase alpha, putative	0.0016	0.0074	0.0037
Echinococcus granulosus	sodium dependent neurotransmitter transporter	0.0015	0.0065	0.0055
Brugia malayi	polk-prov protein	0.0014	0.0047	0.0022
Schistosoma mansoni	dihydropyridine-sensitive l-type calcium channel	0.0063	0.1053	0.1011
Loa Loa (eye worm)	Sodium:neurotransmitter symporter family protein	0.0015	0.0065	0.0169
Plasmodium vivax	hypothetical protein, conserved	0.0015	0.0065	0.6528
Onchocerca volvulus		0.0035	0.0467	0.107
Echinococcus granulosus	sodium:chloride dependent neurotransmitter	0.0101	0.1845	0.1837
Leishmania major	phosphatidylinositol-4-phosphate-5-kinase-likep ro tein	0.0016	0.0074	0.0037
Leishmania major	phosphatidylinositol-4-phosphate 5-kinase-like protein	0.0016	0.0074	0.0037
Schistosoma mansoni	cpg binding protein	0.0037	0.0508	0.0463
Trypanosoma brucei	DNA polymerase beta thumb, putative	0.0051	0.0811	0.1051
Echinococcus granulosus	phosphatidylinositol 5 phosphate 4 kinase type 2	0.0196	0.3821	0.3815
Treponema pallidum	methyl-accepting chemotaxis protein (mcp2-1)	0.0265	0.5247	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0047	0.0714	0.1869
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Echinococcus multilocularis	sodium and chloride dependent glycine	0.0015	0.0065	0.0055
Schistosoma mansoni	sodium/chloride dependent transporter	0.0015	0.0065	0.0018
Brugia malayi	hypothetical protein	0.0015	0.0065	0.0068
Trypanosoma cruzi	phosphatidylinositol-4-phosphate 5-kinase-like, putative	0.0016	0.0074	0.0037
Trypanosoma brucei	DNA polymerase IV, putative	0.0047	0.0714	0.0918
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0015	0.0065	0.0018
Schistosoma mansoni	phosphatidylinositol-4-phosphate 5-kinase type II	0.0016	0.0074	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0077	0.1353	0.354
Schistosoma mansoni	sodium-dependent amino acid transporter	0.0015	0.0065	0.0018
Trypanosoma brucei	phosphatidylinositol (3,5) kinase, putative	0.0016	0.0074	0.0037
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0026	0.0292	0.0764
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0173	0.333	0.4515
Brugia malayi	ImpB/MucB/SamB family protein	0.0077	0.1353	0.3474
Trypanosoma cruzi	phosphatidylinositol-4-phosphate 5-kinase type II beta, putative	0.0016	0.0074	0.0037
Trypanosoma cruzi	DNA polymerase eta, putative	0.0045	0.0686	0.0878
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0047	0.0123
Loa Loa (eye worm)	solute carrier family 6 member 4	0.0015	0.0065	0.0169
Trypanosoma brucei	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Echinococcus multilocularis	dna polymerase kappa	0.0047	0.0714	0.0705
Trypanosoma brucei	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Echinococcus granulosus	dna polymerase eta	0.0077	0.1353	0.1344
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0051	0.0811	0.1051
Schistosoma mansoni	phosphatidylinositol-4-phosphate 5-kinase type II	0.0196	0.3821	0.3792
Plasmodium vivax	phosphatidylinositol-4-phosphate 5-kinase, putative	0.0016	0.0074	1
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0051	0.0811	0.1051
Mycobacterium ulcerans	DNA polymerase IV	0.0047	0.0714	0.1809
Echinococcus multilocularis	dnaJ subfamily B	0.0494	1	1
Giardia lamblia	Hypothetical protein	0.0016	0.0074	0.0401
Echinococcus granulosus	voltage dependent calcium channel subunit	0.013	0.2448	0.244
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0047	0.0714	0.0705
Trypanosoma cruzi	DNA polymerase eta, putative	0.0077	0.1353	0.1796
Trypanosoma brucei	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Trypanosoma brucei	DNA polymerase kappa, putative	0.0032	0.0414	0.0505
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0065	0.0169
Schistosoma mansoni	sodium/chloride dependent transporter	0.0015	0.0065	0.0018
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0292	0.0764
Echinococcus multilocularis	cpg binding protein	0.0037	0.0508	0.0498
Brugia malayi	intermediate filament protein	0.0026	0.0292	0.0669
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0065	0.0169
Echinococcus multilocularis	voltage dependent calcium channel subunit	0.0286	0.5686	0.5681
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Schistosoma mansoni	hypothetical protein	0.0067	0.1142	0.11
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0065	0.0169
Brugia malayi	ImpB/MucB/SamB family protein	0.0047	0.0714	0.1786
Trypanosoma brucei	phosphatidylinositol-4-phosphate 5-kinase, putative	0.0016	0.0074	0.0037
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0015	0.0065	0.0018
Toxoplasma gondii	Sodium:neurotransmitter symporter family protein	0.0015	0.0065	0.0164
Echinococcus multilocularis	phosphatidylinositol 5 phosphate 4 kinase type 2	0.0196	0.3821	0.3815
Schistosoma mansoni	lamin	0.0026	0.0292	0.0246
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0051	0.0811	0.1051
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0015	0.0065	0.0018
Trypanosoma brucei	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0047	0.0714	1
Echinococcus granulosus	sodium and chloride dependent glycine	0.0015	0.0065	0.0055
Schistosoma mansoni	intermediate filament proteins	0.0026	0.0292	0.0246
Loa Loa (eye worm)	serotonin transporter b	0.0015	0.0065	0.0169
Echinococcus granulosus	lamin dm0	0.0026	0.0292	0.0282
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0192	0.3735	1
Echinococcus granulosus	serotonin transporter	0.0015	0.0065	0.0055
Trypanosoma brucei	unspecified product	0.0032	0.0414	0.0505
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0062	0.1044	0.1371
Schistosoma mansoni	phosphatidylinositol-4-phosphate 5-kinase type II	0.0196	0.3821	0.3792
Trypanosoma cruzi	phosphatidylinositol-4-phosphate 5-kinase, putative	0.0016	0.0074	0.0037
Echinococcus granulosus	lamin	0.0026	0.0292	0.0282
Echinococcus multilocularis	Phosphatidylinositol 4 phosphate 5 kinase type 1	0.0016	0.0074	0.0064
Trypanosoma brucei	unspecified product	0.0032	0.0414	0.0505
Brugia malayi	Pip kinase protein 1	0.0016	0.0074	0.0093
Plasmodium vivax	hypothetical protein, conserved	0.0016	0.0074	1
Onchocerca volvulus		0.0026	0.0292	0.0605
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0015	0.0065	0.0068
Plasmodium falciparum	transporter, putative	0.0015	0.0065	0.6528
Echinococcus granulosus	uncharacterized sodium dependent transporter	0.0015	0.0065	0.0055
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0015	0.0065	0.0018
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0065	0.0169
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0047	0.0714	0.0705
Trypanosoma brucei	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Echinococcus multilocularis	sodium:chloride dependent neurotransmitter	0.0101	0.1845	0.1837
Brugia malayi	CXXC zinc finger family protein	0.0035	0.0467	0.1131
Brugia malayi	Sodium:neurotransmitter symporter family protein 1, putative	0.0015	0.0065	0.0068
Echinococcus granulosus	sodium and chloride dependent glycine	0.0015	0.0065	0.0055
Toxoplasma gondii	hypothetical protein	0.0015	0.0065	0.0164
Toxoplasma gondii	ImpB/MucB/SamB family protein	0.0045	0.0686	0.6004
Mycobacterium ulcerans	DNA polymerase IV	0.0047	0.0714	0.1809
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0365	0.7318	1
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0015	0.0065	0.0018
Brugia malayi	Intermediate filament tail domain containing protein	0.0026	0.0292	0.0669
Plasmodium vivax	amine transporter, putative	0.0015	0.0065	0.6528
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0015	0.0065	0.0068
Brugia malayi	Cache domain containing protein	0.0058	0.0943	0.2389
Echinococcus multilocularis	dna polymerase eta	0.0077	0.1353	0.1344
Echinococcus multilocularis	phosphatidylinositol phosphate 5 kinase type III	0.0016	0.0074	0.0064
Trichomonas vaginalis	DNA polymerase eta, putative	0.0047	0.0714	1
Brugia malayi	Pip kinase protein 2	0.0196	0.3821	1
Schistosoma mansoni	DNA polymerase eta	0.0077	0.1353	0.1312
Trypanosoma brucei	mitochondrial DNA polymerase beta	0.0365	0.7318	1
Toxoplasma gondii	Sodium:neurotransmitter symporter family protein	0.0015	0.0065	0.0164
Echinococcus multilocularis	sodium dependent neurotransmitter transporter	0.0015	0.0065	0.0055
Toxoplasma gondii	phosphatidylinositol-4-phosphate 5-kinase	0.0016	0.0074	0.0251
Leishmania major	DNA polymerase eta, putative	0.0045	0.0686	0.0878
Schistosoma mansoni	phosphatidylinositol-4-phosphate-5-kinaseputativ e	0.0016	0.0074	0.0027
Echinococcus granulosus	cpg binding protein	0.0037	0.0508	0.0498
Echinococcus multilocularis	lamin dm0	0.0026	0.0292	0.0282
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0101	0.1845	0.1807
Loa Loa (eye worm)	hypothetical protein	0.0196	0.3821	1
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0047	0.0714	0.0918
Trypanosoma brucei	phosphatidylinositol-4-phosphate 5-kinase, putative	0.0016	0.0074	0.0037
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0066	0.1111	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Trypanosoma brucei	DNA polymerase kappa, putative	0.0032	0.0414	0.0505
Trypanosoma brucei	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0065	0.0169
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0035	0.0467	0.1222
Schistosoma mansoni	cpg binding protein	0.0035	0.0467	0.0422
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0065	0.0169
Toxoplasma gondii	phosphatidylinositol-4-phosphate 5-Kinase	0.0016	0.0074	0.0251
Schistosoma mansoni	phosphatidylinositol-4-phosphate 5-kinase type II	0.0016	0.0074	0.0027
Trypanosoma brucei	DNA polymerase kappa, putative	0.0047	0.0714	0.0918
Leishmania major	phosphatidylinositol (3,5) kinase, putative	0.0016	0.0074	0.0037
Echinococcus multilocularis	sodium and chloride dependent glycine	0.0015	0.0065	0.0055
Echinococcus multilocularis	uncharacterized sodium dependent transporter	0.0015	0.0065	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0101	0.1845	0.4829

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	5.8584 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	10 uM	PubChem BioAssay. qHTS for Inhibitors of PI5P4K: Confirmation in Primary Assay. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	13.1154 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	= 14.1254 um	PUBCHEM_BIOASSAY: qHTS Fluorescence Polarization Assay for Inhibitors of MLL CXXC domain - DNA interaction. (Class of assay: confirmatory) [Related pubchem assays: 2698 (Summary assay.)]	ChEMBL.	No reference
Potency (functional)	= 14.1254 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of DNA Polymerase Beta. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	14.1254 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	ChEMBL.	No reference
Potency (functional)	= 15.8489 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)	19.9526 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Eta. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588636]	ChEMBL.	No reference
Potency (functional)	21.1923 uM	PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	25.1189 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)	70.7946 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)	75.6863 uM	PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PUBCHEM_BIOASSAY: Inhibitors of the vitamin D receptor (VDR): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504855]	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PubChem BioAssay. qHTS for Inhibitors of WRN Helicase. (Class of assay: confirmatory)	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23

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: CHEMBL1483965

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1341399