TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 509.043 | Formula: C27H33ClN6O2
H donors: 3 H acceptors: 3 LogP: 3.21 Rotable bonds: 12
Rule of 5 violations (Lipinski): 2
SMILES: Clc1ccc2c(c1)nccc2NCCCN1CCN(CC1)CCCNC(=O)c1ccc(cc1)C(=O)N
InChi: 1S/C27H33ClN6O2/c28-22-7-8-23-24(9-12-31-25(23)19-22)30-10-1-13-33-15-17-34(18-16-33)14-2-11-32-27(36)21-5-3-20(4-6-21)26(29)35/h3-9,12,19H,1-2,10-11,13-18H2,(H2,29,35)(H,30,31)(H,32,36)
InChiKey: GAVYYQZRZNTWFR-UHFFFAOYSA-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	unc-13 (munc13)	0.00063811	0.00038678	0.00038678
Echinococcus granulosus	protein phosphatase 1 catalytic subunit	0.00083572	0.00179778	0.00179778
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	serine:threonine protein kinase N2	0.000825896	0.00172763	0.00172763
Trichomonas vaginalis	serine/threonine-protein kinase sgk, putative	0.000808081	0.00160042	0.0341389
Plasmodium falciparum	protein phosphatase PPM2	0.00616951	0.0398827	1
Brugia malayi	Protein phosphatase 2C containing protein	0.00616951	0.0398827	0.0398827
Schistosoma mansoni	serine/threonine protein kinase	0.000825896	0.00172763	0.00172763
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Trichomonas vaginalis	bsu-protein phosphatase, putative	0.00083572	0.00179778	0.0391181
Echinococcus multilocularis	receptor type tyrosine protein phosphatase F	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	rgs-gaip interacting protein gipc	0.00368473	0.0221406	0.0221406
Toxoplasma gondii	protein phosphatase 2C domain-containing protein	0.00616951	0.0398827	1
Brugia malayi	hypothetical protein	0.00368473	0.0221406	0.0221406
Trichomonas vaginalis	AGC family protein kinase	0.000825896	0.00172763	0.0373484
Echinococcus multilocularis	protein phosphatase 2C	0.00616951	0.0398827	0.0398827
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Onchocerca volvulus	4.1 G protein, putative homolog	0.00368473	0.0221406	0.555143
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Trypanosoma cruzi	protein phosphatase 2C, putative	0.00616951	0.0398827	1
Trichomonas vaginalis	AGC family protein kinase	0.000825896	0.00172763	0.0373484
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Schistosoma mansoni	protein kinase C mu	0.000601757	0.000127208	0.000127208
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	protein phosphatase 1b	0.0461366	0.325261	0.325261
Echinococcus granulosus	Serine/threonine-protein kinase Genghis Khan	0.000601757	0.000127208	0.000127208
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	protein tyrosine phosphatase non-receptor type nt1	0.140634	1	1
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.000825896	0.00172763	0.00172763
Mycobacterium ulcerans	short chain dehydrogenase	0.0485629	0.342585	0.5
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	serine:threonine protein phosphatase PP1 beta	0.00083572	0.00179778	0.00179778
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.000825896	0.00172763	0.00172763
Brugia malayi	hypothetical protein	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Brugia malayi	Phorbol esters/diacylglycerol binding domain	0.000601757	0.000127208	0.000127208
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Brugia malayi	Dual specificity protein phosphatase CDC14B	0.00368473	0.0221406	0.0221406
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.00368473	0.0221406	0.0221406
Trichomonas vaginalis	AGC family protein kinase	0.000825896	0.00172763	0.0373484
Echinococcus granulosus	RNA directed DNA polymerase	0.00380952	0.0230317	0.0230317
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	protein phosphatase 2c	0.00616951	0.0398827	0.0398827
Brugia malayi	Serine/threonine protein phosphatase F56C9.1 in chromosomeIII	0.00083572	0.00179778	0.00179778
Echinococcus multilocularis	unc 13 (munc13)	0.00063811	0.00038678	0.00038678
Echinococcus granulosus	Protein kinase C brain isozyme	0.00527353	0.0334851	0.0334851
Trichomonas vaginalis	AGC family protein kinase	0.000825896	0.00172763	0.0373484
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.000825896	0.00172763	0.00172763
Toxoplasma gondii	protein phosphatase 2C domain-containing protein	0.00616951	0.0398827	1
Echinococcus multilocularis	serine:threonine protein phosphatase PP1 gamma	0.00083572	0.00179778	0.00179778
Entamoeba histolytica	protein kinase, putative	0.000825896	0.00172763	0.0433178
Plasmodium vivax	protein phosphatase PPM2, putative	0.00616951	0.0398827	1
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	receptor type tyrosine protein phosphatase H	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	protein phosphatase 1b	0.0401401	0.282444	0.282444
Schistosoma mansoni	protein-tyrosine phosphatase n9	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	protein phosphatase 1 catalytic subunit	0.00083572	0.00179778	0.00179778
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00063811	0.00038678	0.00969793
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Entamoeba histolytica	serine/threonine protein phosphatase PP1-2, putative	0.000618578	0.000247315	0.00620104
Brugia malayi	Serine/threonine protein phosphatase PP1-beta catalytic subunit	0.00083572	0.00179778	0.00179778
Trichomonas vaginalis	bsu-protein phosphatase, putative	0.00083572	0.00179778	0.0391181
Schistosoma mansoni	receptor protein tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis		0.00368473	0.0221406	0.0221406
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	serine:threonine protein phosphatase	0.000617708	0.0002411	0.0002411
Loa Loa (eye worm)	serine/threonine protein phosphatase PP1-beta catalytic subunit	0.00083572	0.00179778	0.00179778
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Brugia malayi	Protein kinase domain containing protein	0.000825896	0.00172763	0.00172763
Loa Loa (eye worm)	AGC/NDR protein kinase	0.000825896	0.00172763	0.00172763
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Brugia malayi	hypothetical protein	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	protein tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	serine/threonine protein kinase	0.000825896	0.00172763	0.00172763
Echinococcus multilocularis	protein kinase c iota type	0.00140984	0.00589716	0.00589716
Echinococcus granulosus	protein kinase c iota type	0.00140984	0.00589716	0.00589716
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.000825896	0.00172763	0.00172763
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.000825896	0.00172763	0.00172763
Trypanosoma brucei	protein phosphatase 1, putative	0.00083572	0.00179778	0.00183841
Trichomonas vaginalis	AGC family protein kinase	0.000825896	0.00172763	0.0373484
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	protein-tyrosine phosphatase 1	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	serine/threonine protein kinase	0.00527353	0.0334851	0.0334851
Leishmania major	protein-tyrosine phosphatase 1-like protein	0.00368473	0.0221406	0.534144
Echinococcus multilocularis	Serine threonine specific protein phosphatase bis(5 nucleosyl) tetraphosphatase	0.000618578	0.000247315	0.000247315
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Trichomonas vaginalis	AGC family protein kinase	0.000825896	0.00172763	0.0373484
Echinococcus multilocularis	telomerase reverse transcriptase subunit	0.00380952	0.0230317	0.0230317
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Echinococcus granulosus	protein phosphatase 1 catalytic subunit	0.000618578	0.000247315	0.000247315
Echinococcus multilocularis	serine:threonine protein phosphatase PP1 gamma	0.00083572	0.00179778	0.00179778
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	serine:threonine protein phosphatase PP1 isozyme	0.00083572	0.00179778	0.00179778
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.00368473	0.0221406	0.555143
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.00368473	0.0221406	0.0221406
Trypanosoma cruzi	protein phosphatase 2C-like, putative	0.00616951	0.0398827	1
Echinococcus multilocularis	RNA directed DNA polymerase	0.00380952	0.0230317	0.0230317
Schistosoma mansoni	protein phosphatase 2C	0.0461366	0.325261	0.325261
Echinococcus multilocularis	protein tyrosine phosphatase n9	0.00368473	0.0221406	0.0221406
Entamoeba histolytica	protein kinase, putative	0.000825896	0.00172763	0.0433178
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.000825896	0.00172763	0.00172763
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	protein tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Trichomonas vaginalis	AGC family protein kinase	0.000825896	0.00172763	0.0373484
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Leishmania major	protein phosphatase 2C-like protein	0.00616951	0.0398827	1
Loa Loa (eye worm)	dual specificity protein phosphatase CDC14B	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Echinococcus multilocularis	protein phosphatase 2C	0.00616951	0.0398827	0.0398827
Schistosoma mansoni	serine/threonine protein kinase	0.000601757	0.000127208	0.000127208
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	unc-13 (munc13)	0.00063811	0.00038678	0.00038678
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Loa Loa (eye worm)	hypothetical protein	0.00616951	0.0398827	0.0398827
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.000825896	0.00172763	0.00172763
Schistosoma mansoni	protein tyrosine phosphatase n11 (shp2)	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	C2 calcium dependent membrane targeting	0.00063811	0.00038678	0.00038678
Brugia malayi	protein-tyrosine phosphatase Lar-like precursor, putative	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Trichomonas vaginalis	protein phosphatase-1, putative	0.00083572	0.00179778	0.0391181
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Brugia malayi	C1-like domain containing protein	0.000601757	0.000127208	0.000127208
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.000825896	0.00172763	0.00172763
Schistosoma mansoni	protein phosphatase 2C	0.0401401	0.282444	0.282444
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.00368473	0.0221406	0.0221406
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Brugia malayi	Protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.00146401	0.00628394	0.00628394
Trichomonas vaginalis	protein phosphatase type 2C, putative	0.00616951	0.0398827	1
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Trichomonas vaginalis	AGC family protein kinase	0.000825896	0.00172763	0.0373484
Schistosoma mansoni	protein phosphatase type 1	0.00083572	0.00179778	0.00179778
Schistosoma mansoni	pcd6 interacting protein-related	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	CAMK/PKD protein kinase	0.000601757	0.000127208	0.000127208
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.140634	1	1
Trypanosoma cruzi	tyrosine specific protein phosphatase, putative	0.00368473	0.0221406	0.534144
Trichomonas vaginalis	AGC family protein kinase	0.000825896	0.00172763	0.0373484
Echinococcus multilocularis	serine:threonine protein kinase 38	0.000825896	0.00172763	0.00172763
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	serine/threonine protein kinase	0.00527353	0.0334851	0.0334851
Brugia malayi	Protein phosphatase 2C containing protein	0.0461366	0.325261	0.325261
Echinococcus granulosus	unc 13 munc13	0.00063811	0.00038678	0.00038678
Schistosoma mansoni	protein phosphatase 2C	0.00616951	0.0398827	0.0398827
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	AGC/AKT protein kinase	0.000825896	0.00172763	0.00172763
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Trypanosoma cruzi	tyrosine specific protein phosphatase, putative	0.00368473	0.0221406	0.534144
Echinococcus granulosus	NDR protein kinase	0.000825896	0.00172763	0.00172763
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.00368473	0.0221406	0.0221406
Trichomonas vaginalis	protein phosphatase, caeel, putative	0.00083572	0.00179778	0.0391181
Leishmania major	tyrosine specific protein phosphatase, putative	0.00368473	0.0221406	0.534144
Schistosoma mansoni	protein kinase C	0.00063811	0.00038678	0.00038678
Brugia malayi	Protein kinase domain containing protein	0.000825896	0.00172763	0.00172763
Loa Loa (eye worm)	hypothetical protein	0.00616951	0.0398827	0.0398827
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	serine:threonine protein phosphatase PP1 gamma	0.00083572	0.00179778	0.00179778
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Trichomonas vaginalis	AGC family protein kinase	0.000825896	0.00172763	0.0373484
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Schistosoma mansoni	protein phosphatase-1	0.00083572	0.00179778	0.00179778
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	C2 calcium dependent membrane targeting	0.00063811	0.00038678	0.00038678
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00083572	0.00179778	0.00179778
Brugia malayi	protein kinase C II.	0.00146401	0.00628394	0.00628394
Echinococcus granulosus	serine:threonine protein phosphatase PP1 beta	0.00083572	0.00179778	0.00179778
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Trypanosoma cruzi	tyrosine specific protein phosphatase, putative	0.00368473	0.0221406	0.534144
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Brugia malayi	hypothetical protein	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.140634	1	1
Brugia malayi	Protein kinase c protein 2	0.00446545	0.0277152	0.0277152
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	serine threonine protein kinase	0.00468959	0.0293156	0.0293156
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.000825896	0.00172763	0.00172763
Loa Loa (eye worm)	serine/threonine-protein phosphatase PP1-beta	0.000618578	0.000247315	0.000247315
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.00368473	0.0221406	0.0221406
Trypanosoma brucei	protein phosphatase 2C, putative	0.00616951	0.0398827	1
Trichomonas vaginalis	serine/threonine protein phosphatase, putative	0.00083572	0.00179778	0.0391181
Loa Loa (eye worm)	AGC/PKN protein kinase	0.000825896	0.00172763	0.00172763
Brugia malayi	Protein-tyrosine phosphatase 1	0.00368473	0.0221406	0.0221406
Brugia malayi	Protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	AGC/PKC/IOTA protein kinase	0.000601757	0.000127208	0.000127208
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Schistosoma mansoni	protein phosphatase 2c gamma	0.00616951	0.0398827	0.0398827
Onchocerca volvulus	Putative protein phosphatase 2C	0.00616951	0.0398827	1
Giardia lamblia	Ser/Thr phosphatase 2C, putative	0.00616951	0.0398827	1
Echinococcus multilocularis	protein phosphatase 1b	0.0461366	0.325261	0.325261
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Trichomonas vaginalis	pten, drome, putative	0.00368473	0.0221406	0.552367
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	non-receptor protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	protein phosphatase type 1	0.00083572	0.00179778	0.00179778
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Trypanosoma brucei	protein phosphatase 2C, putative	0.00616951	0.0398827	1
Loa Loa (eye worm)	protein-tyrosine-phosphatase	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.00368473	0.0221406	0.0221406
Trichomonas vaginalis	bsu-protein phosphatase, putative	0.00083572	0.00179778	0.0391181
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Trypanosoma brucei	protein tyrosine phosphatase 1	0.00368473	0.0221406	0.535
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.00368473	0.0221406	0.555143
Brugia malayi	probable protein phosphatase 2C	0.00616951	0.0398827	0.0398827
Schistosoma mansoni	protein tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Toxoplasma gondii	AGC kinase	0.000825896	0.00172763	0.0433178
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Brugia malayi	Protein kinase domain containing protein	0.000601757	0.000127208	0.000127208
Echinococcus granulosus	protein tyrosine phosphatase n9	0.00368473	0.0221406	0.0221406
Toxoplasma gondii	serine/threonine phosophatase PP1	0.00083572	0.00179778	0.0450766
Echinococcus granulosus	serine:threonine protein phosphatase PP1 gamma	0.00083572	0.00179778	0.00179778
Schistosoma mansoni	protein-tyrosine phosphatase non-receptor type nt5	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	protein phosphatase 1, catalytic subunit, beta isozyme	0.00083572	0.00179778	0.00179778
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	atypical protein kinase C	0.00140984	0.00589716	0.00589716
Schistosoma mansoni	protein tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Entamoeba histolytica	Pten 3-phosphoinositide phosphatase, putative	0.00368473	0.0221406	0.555143
Echinococcus multilocularis	Serine threonine specific protein phosphatase bis(5 nucleosyl) tetraphosphatase	0.000618578	0.000247315	0.000247315
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.000825896	0.00172763	0.00172763
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Entamoeba histolytica	protein phosphatase, putative	0.00616951	0.0398827	1
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00380952	0.0230317	0.0230317
Trichomonas vaginalis	AGC family protein kinase	0.000825896	0.00172763	0.0373484
Echinococcus multilocularis	hypothetical protein	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	protein phosphatase 2C	0.0401401	0.282444	0.282444
Loa Loa (eye worm)	hypothetical protein	0.00063811	0.00038678	0.00038678
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	protein phosphatase-1	0.00083572	0.00179778	0.00179778
Echinococcus granulosus	protein kinase C gamma type	0.00468959	0.0293156	0.0293156
Echinococcus multilocularis	protein phosphatase 1 catalytic subunit	0.000618578	0.000247315	0.000247315
Mycobacterium tuberculosis	Probable oxidoreductase	0.0485629	0.342585	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.00146401	0.00628394	0.00628394
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Entamoeba histolytica	protein kinase, putative	0.000825896	0.00172763	0.0433178
Echinococcus granulosus	protein phosphatase 1b	0.0401401	0.282444	0.282444
Echinococcus granulosus	protein kinase c epsilon type	0.00146401	0.00628394	0.00628394
Schistosoma mansoni	serine/threonine kinase	0.000825896	0.00172763	0.00172763
Schistosoma mansoni	receptor protein tyrosine phosphatase r (pcptp1)	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.00368473	0.0221406	0.0221406
Giardia lamblia	Ser/Thr protein phosphatase PP1-alpha 2 catalytic subunit	0.00083572	0.00179778	0.0391181
Schistosoma mansoni	serine/threonine protein kinase	0.000825896	0.00172763	0.00172763
Loa Loa (eye worm)	fibronectin type III domain-containing protein	0.00368473	0.0221406	0.0221406
Brugia malayi	Protein kinase domain containing protein	0.000825896	0.00172763	0.00172763
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.140634	1	1
Loa Loa (eye worm)	AGC/PKC/ALPHA protein kinase	0.00388151	0.0235457	0.0235457
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Schistosoma mansoni	serine/threonine protein kinase	0.000601757	0.000127208	0.000127208
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00368473	0.0221406	0.0221406
Giardia lamblia	Protein tyrosine phosphatase	0.00368473	0.0221406	0.552367
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00368473	0.0221406	0.0221406
Echinococcus multilocularis	serine:threonine protein kinase MRCK beta	0.000601757	0.000127208	0.000127208
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.00527353	0.0334851	0.0334851
Brugia malayi	protein kinase C3,putative	0.000601757	0.000127208	0.000127208
Giardia lamblia	Phosphatase	0.00616951	0.0398827	1
Loa Loa (eye worm)	protein phosphatase 2C containing protein	0.0461366	0.325261	0.325261
Loa Loa (eye worm)	hypothetical protein	0.00439346	0.0272012	0.0272012
Leishmania major	protein phosphatase 2C, putative	0.00616951	0.0398827	1
Echinococcus granulosus	serine:threonine protein kinase N2	0.000825896	0.00172763	0.00172763
Brugia malayi	p70 ribosomal S6 kinase beta	0.000825896	0.00172763	0.00172763
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.000825896	0.00172763	0.00172763
Echinococcus multilocularis	protein kinase c epsilon type	0.00146401	0.00628394	0.00628394
Echinococcus granulosus	protein phosphatase 2c	0.00616951	0.0398827	0.0398827
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.140634	1	1
Brugia malayi	hypothetical protein	0.00368473	0.0221406	0.0221406
Brugia malayi	Hr1 repeat family protein	0.000825896	0.00172763	0.00172763
Echinococcus multilocularis	serine:threonine protein kinase N2	0.000825896	0.00172763	0.00172763
Entamoeba histolytica	protein kinase, putative	0.000825896	0.00172763	0.0433178
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Onchocerca volvulus		0.00368473	0.0221406	0.555143
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.00368473	0.0221406	0.0221406
Entamoeba histolytica	serine/threonine protein phosphatase PP1-2, putative	0.000618578	0.000247315	0.00620104
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.00368473	0.0221406	0.0221406
Loa Loa (eye worm)	hypothetical protein	0.00368473	0.0221406	0.0221406
Schistosoma mansoni	serine/threonine protein kinase	0.000825896	0.00172763	0.00172763
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.00368473	0.0221406	0.0221406

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (ADMET)	0	Cytotoxicity against L6 cells	ChEMBL.	17280835
IC50 (functional)	= 0.083 uM	Antiparasitic activity against chloroquine-sensitive Plasmodium falciparum NF54 in red blood cells by [3H]hypoxanthine incorporation assay	ChEMBL.	17280835
IC50 (functional)	= 0.083 uM	Antiparasitic activity against chloroquine-sensitive Plasmodium falciparum NF54 in red blood cells by [3H]hypoxanthine incorporation assay	ChEMBL.	17280835
IC50 (functional)	= 0.249 uM	Antiparasitic activity against chloroquine and pyrimethamine-resistant Plasmodium falciparum K1 in red blood cells by [3H]hypoxanthine incorporation assay	ChEMBL.	17280835
IC50 (functional)	= 0.249 uM	Antiparasitic activity against chloroquine and pyrimethamine-resistant Plasmodium falciparum K1 in red blood cells by [3H]hypoxanthine incorporation assay	ChEMBL.	17280835
Ratio IC50 (functional)	= 0.33	Ratio of IC50 for Plasmodium falciparum NF54 to IC50 for Plasmodium falciparum K1	ChEMBL.	17280835
Ratio IC50 (functional)	= 0.33	Ratio of IC50 for Plasmodium falciparum NF54 to IC50 for Plasmodium falciparum K1	ChEMBL.	17280835

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23	17280835

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: CHEMBL397419

Bibliographic References

1 literature reference was collected for this gene.

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

Detailed information for compound 436807