TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 350.421 | Formula: C18H22N8
H donors: 3 H acceptors: 4 LogP: 2.48 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CN(c1ccc(cn1)CNc1nccc(n1)Nc1n[nH]c(c1)C1CC1)C
InChi: 1S/C18H22N8/c1-26(2)17-6-3-12(10-20-17)11-21-18-19-8-7-15(23-18)22-16-9-14(24-25-16)13-4-5-13/h3,6-10,13H,4-5,11H2,1-2H3,(H3,19,21,22,23,24,25)
InChiKey: KZHYWBKXNIOPSG-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	p21 protein (Cdc42/Rac)-activated kinase 1	Starlite/ChEMBL	References
Homo sapiens	p21 protein (Cdc42/Rac)-activated kinase 4	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma mansoni	protein kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Brugia malayi	p21/Cdc42/Rac1-activated kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Echinococcus granulosus	serine:threonine protein kinase PAK 1	Get druggable targets OG5_127124	All targets in OG5_127124
Loa Loa (eye worm)	STE/STE20/PAKA protein kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Schistosoma japonicum	IPR000719,Protein kinase;IPR011009,Protein kinase-like,domain-containing	Get druggable targets OG5_127124	All targets in OG5_127124
Candida albicans	likely signal transduction kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Brugia malayi	Protein kinase domain	Get druggable targets OG5_127124	All targets in OG5_127124
Echinococcus multilocularis	p21 activated protein kinase 1 Dpak1	Get druggable targets OG5_127124	All targets in OG5_127124
Schistosoma japonicum	Serine/threonine-protein kinase PAK 3, putative	Get druggable targets OG5_127124	All targets in OG5_127124
Schistosoma japonicum	Serine/threonine-protein kinase STE20, putative	Get druggable targets OG5_127124	All targets in OG5_127124
Schistosoma mansoni	protein kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Loa Loa (eye worm)	STE/STE20/PAKA protein kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Trichomonas vaginalis	STE family protein kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Trichomonas vaginalis	STE family protein kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Schistosoma japonicum	Serine/threonine-protein kinase PAK 1, putative	Get druggable targets OG5_127124	All targets in OG5_127124
Echinococcus multilocularis	serine:threonine protein kinase PAK 3	Get druggable targets OG5_127124	All targets in OG5_127124
Trichomonas vaginalis	STE family protein kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Echinococcus granulosus	serine:threonine protein kinase PAK 3	Get druggable targets OG5_127124	All targets in OG5_127124
Loa Loa (eye worm)	STE/STE20/PAKB protein kinase	Get druggable targets OG5_131977	All targets in OG5_131977
Candida albicans	serine-threonine kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Echinococcus granulosus	p21 activated protein kinase 1 Dpak1	Get druggable targets OG5_127124	All targets in OG5_127124
Brugia malayi	serine/threonine-protein kinase PAK 7	Get druggable targets OG5_131977	All targets in OG5_131977
Candida albicans	likely signal transduction kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Echinococcus multilocularis	serine:threonine protein kinase PAK 3	Get druggable targets OG5_127124	All targets in OG5_127124
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127124	All targets in OG5_127124
Giardia lamblia	Kinase, STE STE20	Get druggable targets OG5_127124	All targets in OG5_127124
Echinococcus granulosus	serine:threonine protein kinase PAK 4	Get druggable targets OG5_131977	All targets in OG5_131977
Schistosoma japonicum	Serine/threonine-protein kinase pak-1, putative	Get druggable targets OG5_127124	All targets in OG5_127124
Entamoeba histolytica	p21-activated kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Trypanosoma cruzi	p21-activated kinase 3, putative	Get druggable targets OG5_127124	All targets in OG5_127124
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_127124	All targets in OG5_127124
Trypanosoma cruzi	STE/STE20 serine/threonine-protein kinase, putative	Get druggable targets OG5_127124	All targets in OG5_127124
Schistosoma japonicum	ko:K04409 p21-activated kinase 1, putative	Get druggable targets OG5_127124	All targets in OG5_127124
Trichomonas vaginalis	mitogen-activated protein kinase kinase kinase 3, MAPKKK3, MEKK3, putative	Get druggable targets OG5_127124	All targets in OG5_127124
Candida albicans	serine-threonine kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Trichomonas vaginalis	conserved hypothetical protein	Get druggable targets OG5_127124	All targets in OG5_127124
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Schistosoma japonicum	Serine/threonine-protein kinase PAK 3, putative	Get druggable targets OG5_127124	All targets in OG5_127124
Echinococcus multilocularis	serine:threonine protein kinase PAK 4	Get druggable targets OG5_131977	All targets in OG5_131977
Trichomonas vaginalis	STE family protein kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_127124	All targets in OG5_127124
Echinococcus granulosus	serine:threonine protein kinase PAK 3	Get druggable targets OG5_127124	All targets in OG5_127124
Schistosoma japonicum	IPR000095,PAK-box/P21-Rho-binding;IPR011026,Wiscott-Aldrich syndrome, C-terminal,domain-containing	Get druggable targets OG5_127124	All targets in OG5_127124

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
Trichomonas vaginalis	conserved hypothetical protein	0.0064	0.2261	0.2057
Onchocerca volvulus	Protein ultraspiracle homolog	0.0017	0.0491	0.0554
Brugia malayi	Nuclear hormone receptor-like 1	0.0009	0.0181	0.0168
Brugia malayi	Tyrosine-protein kinase abl-1	0.0008	0.0149	0.0137
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0017	0.0491	0.0479
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0017	0.0491	0.0479
Echinococcus granulosus	serine:threonine protein kinase PAK 3	0.0064	0.2289	0.3025
Brugia malayi	hypothetical protein	0.0009	0.0181	0.0168
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0017	0.0491	0.0636
Trichomonas vaginalis	set domain proteins, putative	0.0231	0.8643	0.8607
Echinococcus granulosus	c src tyrosine kinase	0.0008	0.0149	0.0181
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0203	0.7574	0.7571
Echinococcus multilocularis	PAK box P21 Rho binding	0.0038	0.1269	0.1669
Trichomonas vaginalis	STE family protein kinase	0.0038	0.1297	0.1067
Trichomonas vaginalis	STE family protein kinase	0.0064	0.2289	0.2086
Loa Loa (eye worm)	nuclear hormone receptor	0.0008	0.0143	0.0131
Plasmodium vivax	SET domain protein, putative	0.0029	0.0943	1
Brugia malayi	Sex muscle abnormal protein 5	0.0007	0.011	0.0097
Trichomonas vaginalis	DNA helicase recq1, putative	0.0021	0.0627	0.0379
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0017	0.0491	0.0479
Schistosoma mansoni	serine/threonine protein kinase	0.0027	0.0854	0.0843
Entamoeba histolytica	p21-activated kinase	0.0064	0.2289	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0943	0.0932
Schistosoma mansoni	nuclear hormone receptor	0.0008	0.0143	0.0131
Brugia malayi	WH1 domain containing protein	0.0038	0.1269	0.1258
Echinococcus granulosus	ecdysone induced protein 78C	0.0017	0.0491	0.0636
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0037	0.1233	0.1622
Brugia malayi	nuclear receptor NHR-88	0.0017	0.0491	0.0479
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0032	0.1057	0.1389
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0017	0.0491	0.0479
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0017	0.0491	0.0479
Schistosoma mansoni	serine/threonine protein kinase	0.0027	0.0854	0.0843
Schistosoma mansoni	nck2/grb4	0.0007	0.011	0.0097
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0032	0.1057	0.1389
Echinococcus granulosus	thyroid hormone receptor alpha	0.0008	0.0143	0.0174
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0017	0.0491	0.0479
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0017	0.0491	0.0479
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Schistosoma mansoni	protein kinase	0.0038	0.1269	0.1258
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.0004	0.0001	0.0006
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0017	0.0491	0.0479
Schistosoma mansoni	tyrosine kinase	0.0005	0.0012	0.000000046562
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0009	0.0181	0.0168
Echinococcus granulosus	p21 activated protein kinase 1 Dpak1	0.0064	0.2289	0.3025
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0017	0.0491	0.0554
Schistosoma mansoni	hypothetical protein	0.005	0.1757	0.1746
Echinococcus granulosus	nuclear receptor nhr 48	0.0008	0.0143	0.0174
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Brugia malayi	nuclear hormone receptor	0.0008	0.0143	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0161	0.0148
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0491	0.0479
Brugia malayi	steroid hormone receptor	0.0017	0.0491	0.0479
Onchocerca volvulus		0.0029	0.0943	0.1079
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.0005	0.0012	0.0054
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0181	0.0168
Loa Loa (eye worm)	RecQ helicase	0.0021	0.0627	0.0615
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0017	0.0491	0.0479
Trichomonas vaginalis	STE family protein kinase	0.0064	0.2289	0.2086
Echinococcus granulosus	neural Wiskott Aldrich syndrome protein	0.0038	0.1269	0.1669
Echinococcus multilocularis	tyrosine protein kinase Abl	0.0008	0.0149	0.0181
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0017	0.0491	0.0479
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0017	0.0491	0.0636
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0014	0.0363	0.3851
Entamoeba histolytica	protein kinase, putative	0.0029	0.0957	0.4179
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Trichomonas vaginalis	STE family protein kinase	0.0064	0.2289	0.2086
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.0037	0.1233	0.1622
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0017	0.0491	0.0479
Echinococcus granulosus	growth factor receptor bound protein 2	0.0007	0.011	0.0129
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase src	0.0008	0.0149	0.0137
Echinococcus granulosus	tyrosine protein kinase Src64B	0.0037	0.1233	0.1622
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0008	0.0143	0.0174
Schistosoma mansoni	tyrosine kinase	0.0039	0.1308	0.1297
Onchocerca volvulus		0.0231	0.8643	1
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0017	0.0491	0.0479
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0943	0.0932
Trichomonas vaginalis	mitogen-activated protein kinase kinase kinase 3, MAPKKK3, MEKK3, putative	0.0027	0.0854	0.0613
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0037	0.1233	0.1622
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.0009	0.0161	0.0148
Schistosoma mansoni	growth factor receptor-bound protein	0.0007	0.011	0.0097
Brugia malayi	p21/Cdc42/Rac1-activated kinase	0.0027	0.0854	0.0843
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0017	0.0491	0.0636
Entamoeba histolytica	hypothetical protein	0.0038	0.1269	0.5541
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0008	0.0143	0.0174
Entamoeba histolytica	protein kinase, putative	0.0038	0.1297	0.5665
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Echinococcus granulosus	NCK adaptor protein	0.0007	0.011	0.0129
Brugia malayi	Variant SH3 domain containing protein	0.0007	0.011	0.0097
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0008	0.0143	0.0131
Entamoeba histolytica	recQ family helicase, putative	0.0011	0.0257	0.1123
Trypanosoma brucei	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0011	0.0257	0.5
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0008	0.0143	0.0174
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Echinococcus granulosus	tyrosine protein kinase shark	0.0005	0.0012	0.000000061785
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0181	0.0168
Brugia malayi	nuclear hormone receptor family member odr-7	0.0008	0.0143	0.0131
Brugia malayi	orphan nuclear receptor NR2E1	0.0008	0.0143	0.0131
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0017	0.0491	0.0636
Brugia malayi	Steroid receptor seven-up type 2	0.0017	0.0491	0.0479
Schistosoma mansoni	thyroid hormone receptor	0.0017	0.0491	0.0479
Echinococcus multilocularis	bloom syndrome protein	0.0021	0.0627	0.0816
Brugia malayi	ecdysteroid receptor	0.0017	0.0491	0.0479
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0017	0.0491	0.0636
Leishmania major	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0011	0.0257	0.5
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0017	0.0491	0.0479
Echinococcus multilocularis	ecdysone induced protein 78C	0.0017	0.0491	0.0636
Onchocerca volvulus	Huntingtin homolog	0.012	0.439	0.5072
Loa Loa (eye worm)	TK protein kinase	0.0033	0.1097	0.1086
Brugia malayi	Bloom's syndrome protein homolog	0.0021	0.0627	0.0615
Echinococcus multilocularis	tyrosine protein kinase Btk29A	0.0008	0.0149	0.0181
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0017	0.0491	0.0479
Echinococcus granulosus	histone lysine methyltransferase setb	0.0029	0.0943	0.1237
Loa Loa (eye worm)	hypothetical protein	0.012	0.439	0.4383
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0008	0.0143	0.0152
Loa Loa (eye worm)	hypothetical protein	0.0064	0.2261	0.2252
Schistosoma mansoni	tyrosine kinase	0.0008	0.0149	0.0137
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0491	0.0479
Loa Loa (eye worm)	P21-Rho-binding domain-containing protein	0.0038	0.1269	0.1258
Brugia malayi	P21-Rho-binding domain containing protein	0.0038	0.1269	0.1258
Loa Loa (eye worm)	STE/STE20/PAKA protein kinase	0.0027	0.0854	0.0843
Schistosoma mansoni	protein kinase	0.0064	0.2289	0.228
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase abl1	0.0007	0.011	0.0097
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0017	0.0491	0.0479
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0008	0.0143	0.0131
Brugia malayi	hypothetical protein	0.0009	0.0181	0.0168
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0017	0.0491	0.0636
Loa Loa (eye worm)	steroid hormone receptor	0.0017	0.0491	0.0479
Echinococcus multilocularis	tyrosine protein kinase Blk	0.0033	0.1097	0.1441
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0009	0.0161	0.1703
Schistosoma mansoni	tyrosine kinase	0.0037	0.1233	0.1222
Brugia malayi	conserved hypotetical protein	0.0008	0.0143	0.0131
Schistosoma mansoni	thyroid hormone receptor	0.0017	0.0491	0.0479
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0017	0.0491	0.0636
Schistosoma mansoni	DNA helicase recq1	0.0009	0.0161	0.0148
Loa Loa (eye worm)	STE/STE20/PAKB protein kinase	0.024	0.8975	0.8973
Echinococcus granulosus	tyrosine protein kinase Blk	0.0033	0.1097	0.1441
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0037	0.1233	0.1622
Brugia malayi	serine/threonine-protein kinase PAK 7	0.024	0.8975	0.8973
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.0007	0.011	0.0097
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0017	0.0491	0.0636
Onchocerca volvulus		0.0008	0.0143	0.0152
Onchocerca volvulus	Bile acid receptor homolog	0.0017	0.0491	0.0554
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0017	0.0491	0.0479
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Brugia malayi	Nuclear hormone receptor E75	0.0008	0.0143	0.0131
Schistosoma mansoni	tyrosine kinase	0.0008	0.0149	0.0137
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0491	0.0479
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0017	0.0491	0.0479
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0017	0.0491	0.0636
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0491	0.0479
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0491	0.0479
Schistosoma mansoni	blooms syndrome DNA helicase	0.0016	0.046	0.0448
Trichomonas vaginalis	STE family protein kinase	0.0064	0.2289	0.2086
Brugia malayi	protein-tyrosine kinase	0.0033	0.1097	0.1086
Echinococcus multilocularis	neural Wiskott Aldrich syndrome protein	0.0038	0.1269	0.1669
Echinococcus granulosus	ATP dependent DNA helicase Q1	0.0009	0.0161	0.0197
Entamoeba histolytica	protein kinase, putative	0.0004	0.0001	0.0006
Echinococcus multilocularis	p21 activated protein kinase 1 Dpak1	0.0064	0.2289	0.3025
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0009	0.0161	0.1703
Brugia malayi	hypothetical protein	0.0008	0.0143	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0181	0.0168
Schistosoma mansoni	protein kinase	0.0064	0.2289	0.228
Brugia malayi	photoreceptor-specific nuclear receptor	0.0017	0.0491	0.0479
Loa Loa (eye worm)	sex muscle abnormal protein 5	0.0007	0.011	0.0097
Schistosoma mansoni	nuclear receptor nhr-48	0.0008	0.0143	0.0131
Brugia malayi	Variant SH3 domain containing protein	0.0007	0.011	0.0097
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.0037	0.1233	0.1622
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0008	0.0143	0.0174
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0029	0.0943	1
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0008	0.0143	0.0174
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0033	0.1097	0.1441
Schistosoma mansoni	zinc finger protein	0.0008	0.0143	0.0131
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.0018	0.053	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0017	0.0491	0.0479
Echinococcus multilocularis	c src tyrosine kinase	0.0008	0.0149	0.0181
Schistosoma mansoni	DNA helicase recq5	0.0009	0.0161	0.0148
Echinococcus multilocularis	ATP dependent DNA helicase Q5	0.0009	0.0161	0.0197
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Schistosoma mansoni	tyrosine kinase	0.0037	0.1233	0.1222
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0943	0.0932
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.0037	0.1233	0.1622
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.0037	0.1233	0.1622
Schistosoma mansoni	hypothetical protein	0.0038	0.1269	0.1258
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0029	0.0943	0.0932
Echinococcus granulosus	PAK box P21 Rho binding	0.0038	0.1269	0.1669
Echinococcus granulosus	FTZ F1 alpha	0.0017	0.0491	0.0636
Schistosoma mansoni	hypothetical protein	0.0038	0.1269	0.1258
Schistosoma mansoni	nuclear receptor	0.0008	0.0143	0.0131
Echinococcus multilocularis	PAK box P21 Rho binding	0.0038	0.1297	0.1707
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0181	0.0168
Brugia malayi	Pre-SET motif family protein	0.0029	0.0943	0.0932
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0009	0.0181	0.0223
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0009	0.0181	0.0168
Schistosoma mansoni	nuclear receptor	0.0008	0.0143	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0943	0.0932
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0017	0.0491	0.0479
Schistosoma mansoni	RAR-like nuclear receptor	0.0017	0.0491	0.0479
Entamoeba histolytica	hypothetical protein	0.0038	0.1269	0.5541
Echinococcus multilocularis	serine:threonine protein kinase PAK 3	0.0064	0.2289	0.3025
Schistosoma mansoni	serine/threonine protein kinase	0.0042	0.1444	0.1434
Trypanosoma cruzi	p21-activated kinase 3, putative	0.0027	0.0854	1
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.0037	0.1233	0.1622
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0009	0.0181	0.0223
Echinococcus granulosus	3'partial\|serine:threonine protein kinase PAK 2	0.0038	0.1269	0.1669
Echinococcus granulosus	serine:threonine protein kinase PAK 1	0.0026	0.0826	0.108
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0009	0.0181	0.0168
Brugia malayi	nuclear hormone receptor	0.0017	0.0491	0.0479
Onchocerca volvulus		0.0017	0.0491	0.0554
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0491	0.0479
Brugia malayi	hypothetical protein	0.0008	0.0143	0.0131
Echinococcus multilocularis	nuclear receptor nhr 48	0.0008	0.0143	0.0174
Schistosoma mansoni	growth factor receptor-bound protein	0.0007	0.011	0.0097
Echinococcus granulosus	bloom syndrome protein	0.0021	0.0627	0.0816
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0017	0.0491	0.0636
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0008	0.0143	0.0152
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0037	0.1233	0.1622
Echinococcus granulosus	serine:threonine protein kinase PAK 3	0.0064	0.2289	0.3025
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0037	0.1233	0.1622
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0017	0.0491	0.0636
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0491	0.0479
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0017	0.0491	0.0479
Echinococcus multilocularis	serine:threonine protein kinase PAK 4	0.0202	0.7539	1
Brugia malayi	ecdysone receptor	0.0008	0.0143	0.0131
Echinococcus multilocularis	tyrosine protein kinase shark	0.0005	0.0012	0.000000061785
Echinococcus granulosus	serine:threonine protein kinase PAK 4	0.0202	0.7539	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0017	0.0491	0.0479
Echinococcus multilocularis	tyrosine protein kinase HCK	0.0029	0.0957	0.1255
Loa Loa (eye worm)	DR-78	0.0008	0.0143	0.0131
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0017	0.0491	0.0479
Echinococcus multilocularis	NCK adaptor protein	0.0007	0.011	0.0129
Brugia malayi	SRC-1	0.0037	0.1233	0.1222
Brugia malayi	nuclear receptor RXR	0.0008	0.0143	0.0131
Brugia malayi	hypothetical protein	0.012	0.439	0.4383
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0017	0.0491	0.0479
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0008	0.0143	0.0131
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0017	0.0491	0.0479
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0008	0.0143	0.0174
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0017	0.0491	0.0479
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0008	0.0143	0.0174
Echinococcus multilocularis	FTZ F1 alpha	0.0017	0.0491	0.0636
Echinococcus granulosus	tyrosine protein kinase Btk29A	0.0008	0.0149	0.0181
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0037	0.1233	0.1622
Echinococcus multilocularis	growth factor receptor bound protein 2	0.0007	0.011	0.0129
Echinococcus multilocularis	serine:threonine protein kinase PAK 3	0.0064	0.2289	0.3025
Brugia malayi	Nuclear hormone receptor-like 1	0.0009	0.0181	0.0168
Brugia malayi	nuclear receptor NHR-67	0.0008	0.0143	0.0131
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0017	0.0491	0.0636
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.0033	0.1097	0.1441
Onchocerca volvulus		0.0008	0.0143	0.0152
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.0037	0.1233	0.1622
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0017	0.0491	0.0479
Schistosoma mansoni	protein kinase	0.0038	0.1297	0.1286
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0017	0.0491	0.0636
Brugia malayi	Protein kinase domain	0.0064	0.2289	0.228
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0181	0.0168
Loa Loa (eye worm)	TK protein kinase	0.0029	0.0957	0.0946
Schistosoma mansoni	hypothetical protein	0.0038	0.1269	0.1258
Brugia malayi	Pre-SET motif family protein	0.0203	0.7574	0.7571
Schistosoma mansoni	nuclear hormone receptor	0.0008	0.0143	0.0131
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0037	0.1233	0.1622
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0028	0.0902	0.1183
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0017	0.0491	0.0636
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0008	0.0143	0.0174
Schistosoma mansoni	wiskott-aldrich syndrome protein	0.0038	0.1269	0.1258
Brugia malayi	Nuclear hormone receptor-like 1	0.0017	0.0491	0.0479
Onchocerca volvulus	Huntingtin homolog	0.012	0.439	0.5072
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0029	0.0943	0.1237
Entamoeba histolytica	protein kinase, putative	0.0064	0.2289	1
Echinococcus multilocularis	tyrosine protein kinase Srms	0.0033	0.1097	0.1441
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0009	0.0161	0.0148
Brugia malayi	tailless protein	0.0008	0.0143	0.0131
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0008	0.0143	0.0174
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0037	0.1233	0.1622
Echinococcus granulosus	ATP dependent DNA helicase Q5	0.0009	0.0161	0.0197
Schistosoma mansoni	coup transcription factor	0.0017	0.0491	0.0479
Loa Loa (eye worm)	STE/STE20/PAKA protein kinase	0.0027	0.0854	0.0843
Loa Loa (eye worm)	hypothetical protein	0.0007	0.011	0.0097
Brugia malayi	Nuclear hormone receptor E75	0.0008	0.0143	0.0131
Trypanosoma cruzi	STE/STE20 serine/threonine-protein kinase, putative	0.0027	0.0854	1
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0466	0.0454
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0008	0.0143	0.0131
Brugia malayi	nuclear receptor RXR	0.0009	0.0181	0.0168
Loa Loa (eye worm)	SRC-1	0.0037	0.1233	0.1222
Schistosoma mansoni	adapter molecule crk	0.0007	0.011	0.0097
Trichomonas vaginalis	DNA helicase recq, putative	0.0021	0.0627	0.0379
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Brugia malayi	nuclear receptor NHR-88	0.0008	0.0143	0.0131
Schistosoma mansoni	retinoic acid receptor RXR	0.0017	0.0491	0.0479
Giardia lamblia	Kinase, STE STE20	0.0064	0.2289	1
Schistosoma mansoni	nuclear hormone receptor	0.0017	0.0491	0.0479
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0491	0.0479
Echinococcus granulosus	tyrosine protein kinase Lyn	0.0037	0.1262	0.166
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0009	0.0161	0.0148
Entamoeba histolytica	protein kinase, putative	0.0038	0.1297	0.5665
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0008	0.0143	0.0131
Entamoeba histolytica	protein kinase, putative	0.0038	0.1297	0.5665
Loa Loa (eye worm)	hypothetical protein	0.012	0.439	0.4383
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Echinococcus granulosus	tyrosine kinase	0.0033	0.1097	0.1441
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.0037	0.1233	0.1622
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0017	0.0491	0.0479
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0029	0.0943	0.1237
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0143	0.0131
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0008	0.0143	0.0131
Brugia malayi	P21-Rho-binding domain containing protein	0.0038	0.1269	0.1258
Echinococcus multilocularis	ATP dependent DNA helicase Q1	0.0009	0.0161	0.0197
Echinococcus granulosus	tyrosine protein kinase HCK	0.0029	0.0957	0.1255

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 907 nM	Inhibition of human recombinant PAK4 kinase domain using coumarin/fluorescein-labeled FRET peptide as substrate assessed as substrate phosphorylation at Ser/Thr19 preincubated for 10 mins followed by ATP addition measured after 60 mins by Z'-LYTE assay	ChEMBL.	26030457
Ki (binding)	= 1470 nM	Inhibition of human recombinant PAK1 kinase domain using coumarin/fluorescein-labeled FRET peptide as substrate assessed as substrate phosphorylation at Ser/Thr19 preincubated for 10 mins followed by ATP addition measured after 60 mins by Z'-LYTE assay	ChEMBL.	26030457

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: CHEMBL3580966

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1940862