TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 440.512 | Formula: C23H24N2O5S
H donors: 1 H acceptors: 2 LogP: 4.08 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: COc1cc(cc(c1OC)OC)S(=O)(=O)Nc1ccc2c(c1)c1ccccc1n2CC
InChi: 1S/C23H24N2O5S/c1-5-25-19-9-7-6-8-17(19)18-12-15(10-11-20(18)25)24-31(26,27)16-13-21(28-2)23(30-4)22(14-16)29-3/h6-14,24H,5H2,1-4H3
InChiKey: BNALQXASABMWQB-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

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
Plasmodium falciparum	RAC-beta serine/threonine protein kinase	0.008	0.0626	0.1335
Entamoeba histolytica	protein kinase, putative	0.0119	0.1169	0.169
Trypanosoma brucei	protein kinase, putative	0.0113	0.1081	0.8302
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.006	0.0345	0.0308
Schistosoma mansoni	glycogen synthase kinase 3-related (gsk3) (cmgc group III)	0.0059	0.0337	0.018
Echinococcus granulosus	c-Jun N-terminal kinases	0.0473	0.6086	0.6071
Giardia lamblia	Kinase, NEK	0.0114	0.1104	0.8555
Schistosoma mansoni	protein kinase	0.0123	0.1228	0.1086
Echinococcus multilocularis		0.0232	0.2742	0.2713
Toxoplasma gondii	AGC kinase	0.0115	0.1112	0.8643
Echinococcus multilocularis	mitogen activated protein kinase	0.0113	0.1081	0.1047
Echinococcus granulosus	protein kinase C gamma type	0.0046	0.016	0.0121
Brugia malayi	Protein kinase domain containing protein	0.0092	0.0799	0.0714
Echinococcus multilocularis	neural Wiskott Aldrich syndrome protein	0.0047	0.0166	0.0128
Trichomonas vaginalis	AGC family protein kinase	0.0119	0.1169	0.4674
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.0046	0.016	0.0121
Echinococcus granulosus	TGF beta receptor type 1	0.0083	0.0669	0.0633
Plasmodium falciparum	NIMA related kinase 1	0.0114	0.1104	0.3544
Loa Loa (eye worm)	CMGC/MAPK/JNK protein kinase	0.0473	0.6086	0.6071
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.008	0.0626	0.059
Schistosoma mansoni	serine/threonine protein kinase	0.0215	0.2501	0.238
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0084	0.0683	0.0964
Schistosoma mansoni	tyrosine kinase	0.0244	0.2905	0.279
Trichomonas vaginalis	AGC family protein kinase	0.0119	0.1169	0.4674
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0046	0.016	0.0121
Echinococcus multilocularis	serine:threonine protein kinase PAK 3	0.0123	0.1228	0.1194
Brugia malayi	Protein kinase domain containing protein	0.0288	0.3521	0.3462
Echinococcus granulosus	protein kinase c epsilon type	0.0046	0.016	0.0121
Echinococcus multilocularis	serine:threonine protein kinase PAK 3	0.0123	0.1228	0.1194
Schistosoma mansoni	serine/threonine protein kinase	0.0473	0.6086	0.6022
Echinococcus multilocularis	c Jun NH2 terminal kinase	0.0473	0.6086	0.6071
Schistosoma mansoni	serine/threonine protein kinase	0.0076	0.0576	0.0423
Echinococcus multilocularis	serine:threonine protein kinase receptor R3	0.0083	0.0669	0.0633
Echinococcus multilocularis	protein kinase c epsilon type	0.0046	0.016	0.0121
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0059	0.0337	0.03
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0042	0.0091	0.0053
Schistosoma mansoni	serine/threonine protein kinase	0.0153	0.1646	0.1511
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.008	0.0626	0.3224
Brugia malayi	Protein kinase domain	0.0123	0.1228	0.1147
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.0046	0.016	0.0121
Schistosoma mansoni	tyrosine kinase	0.006	0.0345	0.0189
Echinococcus multilocularis	vaccinia related kinase 1	0.0161	0.1756	0.1724
Echinococcus granulosus	serine:threonine protein kinase N2	0.0046	0.016	0.0121
Echinococcus granulosus	neural Wiskott Aldrich syndrome protein	0.0047	0.0166	0.0128
Schistosoma mansoni	protein kinase	0.0083	0.0669	0.0517
Schistosoma mansoni	serine/threonine protein kinase	0.0072	0.0521	0.0367
Giardia lamblia	Kinase, AGC PKA	0.008	0.0626	0.3224
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.0042	0.0091	0.0053
Echinococcus multilocularis	PAK box P21 Rho binding	0.0058	0.0326	0.0288
Echinococcus multilocularis	TGF beta receptor type 1	0.0083	0.0669	0.0633
Echinococcus multilocularis	tyrosine protein kinase Blk	0.0042	0.0091	0.0053
Echinococcus granulosus	serine:threonine protein kinase	0.0092	0.0799	0.0763
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0113	0.1081	0.8302
Giardia lamblia	Kinase, STE STE20	0.0123	0.1228	0.9936
Brugia malayi	serine/threonine protein kinase 6	0.0124	0.1234	0.1153
Schistosoma mansoni	tyrosine kinase	0.006	0.0345	0.0189
Echinococcus multilocularis	nervana 2	0.0069	0.0467	0.043
Loa Loa (eye worm)	CK1/VRK protein kinase	0.0161	0.1756	0.1724
Echinococcus granulosus	aurora kinase A	0.0124	0.1234	0.1199
Schistosoma mansoni	serine/threonine-protein kinase	0.0084	0.0683	0.0532
Entamoeba histolytica	protein kinase domain containing protein	0.0059	0.0337	0.0446
Trichomonas vaginalis	AGC family protein kinase	0.0119	0.1169	0.4674
Schistosoma mansoni	serine/threonine protein kinase	0.0192	0.2177	0.2051
Loa Loa (eye worm)	TK/ALK protein kinase	0.0244	0.291	0.2883
Schistosoma mansoni	serine/threonine protein kinase	0.0072	0.0521	0.0367
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0084	0.0683	0.0964
Trichomonas vaginalis	AGC family protein kinase	0.0046	0.016	0.0638
Schistosoma mansoni	protein kinase	0.0123	0.1228	0.1086
Brugia malayi	serine/threonine-protein kinase PAK 7	0.0058	0.0326	0.0237
Trichomonas vaginalis	STE family protein kinase	0.0123	0.1228	0.4909
Echinococcus multilocularis	p21 activated protein kinase 1 Dpak1	0.0123	0.1228	0.1194
Brugia malayi	hypothetical protein	0.0061	0.0363	0.0274
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.0113	0.1081	0.8302
Plasmodium falciparum	serine/threonine protein kinase, putative	0.0124	0.1234	0.4142
Entamoeba histolytica	protein kinase, putative	0.0063	0.0383	0.0515
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	0.0069	0.0467	0.043
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.0113	0.1081	0.8302
Echinococcus multilocularis	calcium activated potassium channel	0.0072	0.0521	0.0484
Schistosoma mansoni	serine/threonine protein kinase	0.0076	0.0576	0.0423
Loa Loa (eye worm)	hypothetical protein	0.0208	0.24	0.237
Trypanosoma cruzi	STE/STE20 serine/threonine-protein kinase, putative	0.0076	0.0576	0.266
Brugia malayi	serine/threonine kinase 12	0.0124	0.1234	0.1153
Trichomonas vaginalis	CMGC family protein kinase	0.0113	0.1081	0.4323
Echinococcus granulosus	serine:threonine protein kinase	0.0092	0.0799	0.0763
Brugia malayi	WH1 domain containing protein	0.0047	0.0166	0.0076
Brugia malayi	Kinase associated domain 1 family protein	0.0061	0.0362	0.0273
Schistosoma mansoni	tyrosine kinase	0.0399	0.5057	0.4977
Brugia malayi	serine/threonine-protein kinase 6	0.0124	0.1234	0.1153
Echinococcus granulosus	serine threonine protein kinase	0.0215	0.2501	0.2472
Echinococcus multilocularis	epidermal growth factor receptor	0.0755	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0112	0.1068	0.4271
Echinococcus granulosus	protein kinase shaggy	0.0059	0.0337	0.03
Brugia malayi	Protein kinase domain containing protein	0.0046	0.016	0.0069
Schistosoma mansoni	tyrosine kinase	0.0399	0.5057	0.4977
Schistosoma mansoni	protein kinase	0.0058	0.0326	0.0169
Entamoeba histolytica	protein kinase, putative	0.0063	0.0383	0.0515
Trichomonas vaginalis	STE family protein kinase	0.0114	0.1104	0.4414
Toxoplasma gondii	NIMA-related protein kinase NIMA1	0.0114	0.1104	0.8555
Entamoeba histolytica	hypothetical protein	0.0047	0.0166	0.0191
Schistosoma mansoni	wiskott-aldrich syndrome protein	0.0047	0.0166	0.0007
Loa Loa (eye worm)	TKL/STKR/TYPE1 protein kinase	0.008	0.0627	0.0591
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.0113	0.1081	0.8302
Loa Loa (eye worm)	AUR protein kinase	0.0124	0.1234	0.1199
Trichomonas vaginalis	AGC family protein kinase	0.0046	0.016	0.0638
Echinococcus granulosus	tyrosine protein kinase Lyn	0.0071	0.0505	0.0468
Trichomonas vaginalis	CAMK family protein kinase	0.0092	0.0799	0.3193
Trypanosoma brucei	rac serine-threonine kinase, putative	0.0119	0.1169	0.9281
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.006	0.0345	0.0308
Schistosoma mansoni	serine/threonine protein kinase	0.0124	0.1234	0.1091
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.006	0.0345	0.0308
Trichomonas vaginalis	AGC family protein kinase	0.0124	0.1234	0.4932
Giardia lamblia	Kinase, NEK	0.0114	0.1104	0.8555
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0363	0.0325
Loa Loa (eye worm)	TKL/STKR/TYPE2 protein kinase	0.0073	0.0522	0.0486
Trichomonas vaginalis	AGC family protein kinase	0.0119	0.1169	0.4674
Brugia malayi	P21-Rho-binding domain containing protein	0.0047	0.0166	0.0076
Schistosoma mansoni	hypothetical protein	0.0061	0.0362	0.0205
Entamoeba histolytica	protein kinase, putative	0.0119	0.1169	0.169
Entamoeba histolytica	protein kinase, putative	0.0124	0.1234	0.1786
Trichomonas vaginalis	AGC family protein kinase	0.0119	0.1169	0.4674
Trichomonas vaginalis	STE family protein kinase	0.0215	0.2501	1
Loa Loa (eye worm)	AGC/NDR protein kinase	0.0046	0.016	0.0121
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.0046	0.016	0.0121
Loa Loa (eye worm)	STE/STE20/PAKA protein kinase	0.0076	0.0576	0.0539
Loa Loa (eye worm)	AUR protein kinase	0.0124	0.1234	0.1199
Echinococcus granulosus	Protein kinase C brain isozyme	0.0046	0.016	0.0121
Echinococcus multilocularis	serine:threonine protein kinase MARK2	0.0153	0.1646	0.1614
Echinococcus granulosus	serine:threonine protein kinase PAK 3	0.0123	0.1228	0.1194
Echinococcus granulosus	serine threonine protein kinase nrc	0.008	0.0626	0.059
Entamoeba histolytica	serine/threonine- protein kinase 6, putative	0.0124	0.1234	0.1786
Echinococcus granulosus	serine/threonine protein kinase	0.0084	0.0683	0.0647
Echinococcus granulosus	serine:threonine protein kinase MARK2	0.0153	0.1646	0.1614
Echinococcus multilocularis	protein kinase shaggy	0.0059	0.0337	0.03
Entamoeba histolytica	protein kinase, putative	0.0124	0.1234	0.1786
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0084	0.0683	0.3862
Loa Loa (eye worm)	AGC/PKN protein kinase	0.0046	0.016	0.0121
Loa Loa (eye worm)	CAMK/CAMKL/MELK protein kinase	0.0072	0.0521	0.0484
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.0046	0.016	0.0121
Trichomonas vaginalis	AGC family protein kinase	0.0119	0.1169	0.4674
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.0113	0.1081	0.8302
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0119	0.1169	0.1135
Echinococcus multilocularis	protein kinase c iota type	0.0046	0.016	0.0121
Echinococcus granulosus	3'partial\|serine:threonine protein kinase PAK 2	0.0047	0.0166	0.0128
Schistosoma mansoni	hypothetical protein	0.0047	0.0166	0.0007
Echinococcus granulosus	serine:threonine protein kinase PAK 1	0.0065	0.0416	0.0379
Loa Loa (eye worm)	STE/STE20/PAKA protein kinase	0.0076	0.0576	0.0539
Echinococcus multilocularis	activin receptor type	0.0386	0.4873	0.4853
Loa Loa (eye worm)	TK protein kinase	0.0042	0.0091	0.0053
Loa Loa (eye worm)	CAMK/CAMKL/MARK protein kinase	0.0092	0.0799	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0799	0.0763
Echinococcus multilocularis	MAP kinase activated protein kinase 2	0.0192	0.2177	0.2147
Echinococcus granulosus	nervana 2	0.0069	0.0467	0.043
Echinococcus granulosus	PAK box P21 Rho binding	0.0047	0.0166	0.0128
Entamoeba histolytica	protein kinase domain containing protein	0.0124	0.1234	0.1786
Schistosoma mansoni	serine/threonine protein kinase	0.0074	0.0539	0.0385
Echinococcus multilocularis	Glutaredoxin protein 5	0.0069	0.0467	0.043
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.008	0.0626	0.059
Echinococcus multilocularis	epidermal growth factor receptor	0.0407	0.5175	0.5157
Schistosoma mansoni	tyrosine kinase	0.0055	0.0284	0.0127
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0046	0.016	0.0121
Plasmodium vivax	NIMA-related protein kinase (Pfnek-1), putative	0.0114	0.1104	0.3544
Echinococcus granulosus	MAP kinase activated protein kinase 2	0.0192	0.2177	0.2147
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.006	0.0345	0.0308
Entamoeba histolytica	protein kinase domain containing protein	0.0519	0.6729	1
Echinococcus granulosus	calcium activated potassium channel	0.0072	0.0521	0.0484
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.0113	0.1081	0.8302
Schistosoma mansoni	tyrosine kinase	0.0407	0.5175	0.5097
Brugia malayi	p21/Cdc42/Rac1-activated kinase	0.0076	0.0576	0.0489
Trichomonas vaginalis	AGC family protein kinase	0.0119	0.1169	0.4674
Trichomonas vaginalis	STE family protein kinase	0.0123	0.1228	0.4909
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.0046	0.016	0.0121
Trichomonas vaginalis	CMGC family protein kinase	0.0113	0.1081	0.4323
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.0113	0.1081	0.8302
Loa Loa (eye worm)	hypothetical protein	0.0277	0.3362	0.3336
Entamoeba histolytica	protein kinase , putative	0.0124	0.1234	0.1786
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	0.0069	0.0467	0.043
Schistosoma mansoni	protein kinase	0.0124	0.1234	0.1091
Loa Loa (eye worm)	camk/mapkapk/mapkapk protein kinase	0.0192	0.2177	0.2147
Entamoeba histolytica	serine/threonine- protein kinase 6 , putative	0.0124	0.1234	0.1786
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.006	0.0345	0.0308
Trypanosoma brucei	aurora B kinase	0.0124	0.1234	1
Schistosoma mansoni	serine/threonine kinase	0.0072	0.0521	0.0367
Brugia malayi	p70 ribosomal S6 kinase beta	0.0115	0.1112	0.103
Trichomonas vaginalis	AGC family protein kinase	0.0124	0.1234	0.4932
Echinococcus granulosus	tyrosine protein kinase Src42A	0.006	0.0345	0.0308
Trypanosoma cruzi	aurora B kinase, putative	0.0124	0.1234	1
Brugia malayi	protein kinase C II.	0.0046	0.016	0.0069
Giardia lamblia	Aurora kinase	0.0124	0.1234	1
Echinococcus multilocularis	tyrosine protein kinase Srms	0.0042	0.0091	0.0053
Brugia malayi	Protein kinase domain containing protein	0.0072	0.0521	0.0434
Trichomonas vaginalis	CMGC family protein kinase	0.0113	0.1081	0.4323
Echinococcus granulosus	protein kinase c iota type	0.0046	0.016	0.0121
Plasmodium vivax	rac-beta serine/threonine protein kinase, putative	0.008	0.0626	0.1335
Echinococcus granulosus	glycogen synthase kinase 3 beta	0.0059	0.0337	0.03
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.006	0.0345	0.0308
Trichomonas vaginalis	AGC family protein kinase	0.0124	0.1234	0.4932
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.0046	0.016	0.0121
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0113	0.1081	0.8302
Entamoeba histolytica	serine/threonine protein kinase 6, putative	0.0124	0.1234	0.1786
Brugia malayi	Protein kinase domain containing protein	0.0244	0.2905	0.284
Giardia lamblia	Kinase, NEK	0.0114	0.1104	0.8555
Echinococcus multilocularis	serine:threonine protein kinase 12 B	0.0124	0.1234	0.1199
Entamoeba histolytica	protein kinase 2, putative	0.008	0.0626	0.0878
Brugia malayi	MAP kinase sur-1	0.0113	0.1081	0.0999
Entamoeba histolytica	protein kinase, putative	0.0059	0.0337	0.0446
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.0113	0.1081	0.1047
Entamoeba histolytica	protein kinase, putative	0.0046	0.016	0.0181
Brugia malayi	Stress-activated protein kinase jnk-1	0.0473	0.6086	0.605
Giardia lamblia	Kinase, CMGC MAPK	0.0113	0.1081	0.8302
Echinococcus multilocularis	PAK box P21 Rho binding	0.0047	0.0166	0.0128
Trichomonas vaginalis	mitogen-activated protein kinase kinase kinase 3, MAPKKK3, MEKK3, putative	0.0076	0.0576	0.2301
Echinococcus multilocularis	homeodomain interacting protein kinase 3	0.0519	0.6729	0.6716
Trichomonas vaginalis	CAMK family protein kinase	0.0072	0.0521	0.2084
Loa Loa (eye worm)	TKL/STKR/TYPE1 protein kinase	0.0073	0.0522	0.0486
Echinococcus granulosus	epidermal growth factor receptor	0.0407	0.5175	0.5157
Brugia malayi	protein C17H12.11	0.0061	0.0363	0.0274
Brugia malayi	map kinase activated protein kinase protein 2	0.0192	0.2177	0.2105
Brugia malayi	bone morphogenetic protein type 1 receptor	0.008	0.0627	0.0541
Schistosoma mansoni	hypothetical protein	0.0061	0.0362	0.0205
Entamoeba histolytica	protein kinase, putative	0.0123	0.1228	0.1777
Schistosoma mansoni	serine/threonine protein kinase	0.0113	0.1081	0.0937
Brugia malayi	intracellular kinase	0.0059	0.0337	0.0248
Echinococcus granulosus	insulin receptor	0.0244	0.2905	0.2877
Echinococcus granulosus	tyrosine protein kinase Fyn	0.006	0.0345	0.0308
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.006	0.0345	0.0308
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0046	0.016	0.0121
Leishmania major	protein kinase, putative	0.0124	0.1234	1
Schistosoma mansoni	protein kinase	0.0161	0.1756	0.1622
Entamoeba histolytica	protein kinase, putative	0.0215	0.2501	0.3681
Entamoeba histolytica	protein kinase domain containing protein	0.0059	0.0337	0.0446
Brugia malayi	P21-Rho-binding domain containing protein	0.0047	0.0166	0.0076
Echinococcus granulosus	mitogen activated protein kinase 3	0.0113	0.1081	0.1047
Toxoplasma gondii	aurora kinase	0.0124	0.1234	1
Trichomonas vaginalis	AGC family protein kinase	0.0124	0.1234	0.4932
Brugia malayi	Hr1 repeat family protein	0.0046	0.016	0.0069
Trichomonas vaginalis	STE family protein kinase	0.0123	0.1228	0.4909
Entamoeba histolytica	p21-activated kinase	0.0127	0.1285	0.1863
Echinococcus granulosus	mitogen activated protein kinase	0.0113	0.1081	0.1047
Echinococcus granulosus	melanoma receptor tyrosine protein kinase	0.0407	0.5175	0.5157
Echinococcus granulosus	Glutaredoxin protein 5	0.0069	0.0467	0.043
Plasmodium vivax	serine/threonine-specific protein kinase, putative	0.0215	0.2501	1
Echinococcus multilocularis	rac serine:threonine kinase	0.0084	0.0683	0.0647
Loa Loa (eye worm)	STE/STE20/PAKB protein kinase	0.0058	0.0326	0.0288
Brugia malayi	Protein kinase domain containing protein	0.0161	0.1756	0.168
Schistosoma mansoni	hypothetical protein	0.0047	0.0166	0.0007
Loa Loa (eye worm)	STE/STE20/YSK protein kinase	0.0215	0.2501	0.2472
Echinococcus multilocularis	nervana 2	0.0069	0.0467	0.043
Schistosoma mansoni	tyrosine kinase	0.0399	0.5057	0.4977
Trichomonas vaginalis	CMGC family protein kinase	0.0113	0.1081	0.4323
Brugia malayi	Protein kinase domain containing protein	0.0046	0.016	0.0069
Echinococcus granulosus	serine:threonine protein kinase 12 B	0.0124	0.1234	0.1199
Echinococcus multilocularis	serine threonine protein kinase	0.0215	0.2501	0.2472
Echinococcus granulosus	homeodomain interacting protein kinase 3	0.0519	0.6729	0.6716
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.006	0.0345	0.0308
Schistosoma mansoni	hypothetical protein	0.0047	0.0166	0.0007
Echinococcus granulosus	tyrosine kinase	0.0042	0.0091	0.0053
Echinococcus multilocularis	mitogen activated protein kinase 3	0.0113	0.1081	0.1047
Brugia malayi	SRC-1	0.006	0.0345	0.0257
Entamoeba histolytica	protein kinase, putative	0.0115	0.1112	0.1604
Echinococcus granulosus	vaccinia related kinase 1	0.0161	0.1756	0.1724
Schistosoma mansoni	serine/threonine protein kinase	0.0153	0.1646	0.1511
Echinococcus multilocularis	serine:threonine protein kinase MARK2	0.0153	0.1646	0.1614
Echinococcus multilocularis	hypothetical protein	0.0061	0.0362	0.0324
Echinococcus granulosus	tyrosine protein kinase Fyn	0.006	0.0345	0.0308
Entamoeba histolytica	hypothetical protein	0.0047	0.0166	0.0191
Echinococcus granulosus	serine:threonine protein kinase PAK 3	0.0123	0.1228	0.1194
Echinococcus multilocularis	glycogen synthase kinase 3 beta	0.0059	0.0337	0.03
Echinococcus granulosus	insulin growth factor 1 receptor beta	0.0244	0.2905	0.2877
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0362	0.0324
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.0046	0.016	0.0121
Loa Loa (eye worm)	TK/INSR protein kinase	0.0244	0.2905	0.2877
Echinococcus granulosus	TGF-beta receptor type-1	0.0083	0.0669	0.0633
Schistosoma mansoni	protein kinase	0.008	0.0627	0.0475
Echinococcus granulosus	p21 activated protein kinase 1 Dpak1	0.0123	0.1228	0.1194
Plasmodium vivax	serine/threonine protein kinase 6, putative	0.0124	0.1234	0.4142
Trichomonas vaginalis	STE family protein kinase	0.0215	0.2501	1
Schistosoma mansoni	tyrosine kinase	0.0244	0.2905	0.279
Loa Loa (eye worm)	CMGC/DYRK/HIPK protein kinase	0.0519	0.6729	0.6716
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.006	0.0345	0.0308
Echinococcus multilocularis	insulin growth factor 1 receptor beta	0.0244	0.2905	0.2877
Echinococcus multilocularis	serine:threonine protein kinase	0.0092	0.0799	0.0763
Echinococcus granulosus	tyrosine protein kinase Blk	0.0042	0.0091	0.0053
Plasmodium falciparum	protein kinase, putative	0.0215	0.2501	1
Echinococcus granulosus	activin receptor type	0.0386	0.4873	0.4853
Echinococcus multilocularis	insulin receptor	0.0244	0.2905	0.2877
Schistosoma mansoni	tyrosine kinase	0.0755	1	1
Echinococcus granulosus	serine:threonine protein kinase MARK2	0.0153	0.1646	0.1614
Echinococcus granulosus	epidermal growth factor receptor	0.0755	1	1
Entamoeba histolytica	protein kinase, putative	0.0058	0.0326	0.0429
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0755	1	1
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0059	0.0337	0.03
Schistosoma mansoni	serine/threonine protein kinase	0.0519	0.6729	0.6676
Loa Loa (eye worm)	P21-Rho-binding domain-containing protein	0.0047	0.0166	0.0128
Echinococcus granulosus	NDR protein kinase	0.0046	0.016	0.0121
Schistosoma mansoni	serine/threonine protein kinase	0.0072	0.0521	0.0367
Brugia malayi	Homeodomain interacting protein kinase protein 1	0.0519	0.6729	0.6699
Trichomonas vaginalis	STE family protein kinase	0.0123	0.1228	0.4909
Echinococcus granulosus	tyrosine protein kinase Fyn	0.006	0.0345	0.0308
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.006	0.0345	0.0308
Trichomonas vaginalis	AGC family protein kinase	0.0114	0.1104	0.4414
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.0046	0.016	0.0121
Loa Loa (eye worm)	hypothetical protein	0.0046	0.016	0.0121
Echinococcus multilocularis	serine:threonine protein kinase	0.0092	0.0799	0.0763
Schistosoma mansoni	tyrosine kinase	0.0407	0.5175	0.5097
Trichomonas vaginalis	AGC family protein kinase	0.0046	0.016	0.0638
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.006	0.0345	0.0308
Trypanosoma cruzi	p21-activated kinase 3, putative	0.0076	0.0576	0.266
Brugia malayi	Protein kinase domain containing protein	0.0073	0.0522	0.0435
Trichomonas vaginalis	CMGC family protein kinase	0.0059	0.0337	0.1348
Echinococcus granulosus	tyrosine protein kinase Src64B	0.006	0.0345	0.0308
Schistosoma mansoni	protein kinase	0.0047	0.0166	0.0007
Trichomonas vaginalis	AGC family protein kinase	0.0051	0.0217	0.0867
Trichomonas vaginalis	STE family protein kinase	0.0058	0.0326	0.1303
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.0046	0.016	0.0121
Echinococcus granulosus	nervana 2	0.0069	0.0467	0.043
Echinococcus multilocularis	serine:threonine protein kinase 38	0.0046	0.016	0.0121
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0046	0.016	0.0121
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.0115	0.1112	0.1077
Brugia malayi	Protein kinase domain containing protein	0.0119	0.1169	0.1088
Schistosoma mansoni	serine/threonine-protein kinase	0.0084	0.0683	0.0532
Loa Loa (eye worm)	hypothetical protein	0.0112	0.1068	0.1034
Echinococcus multilocularis	aurora kinase A	0.0124	0.1234	0.1199
Loa Loa (eye worm)	AUR protein kinase	0.0124	0.1234	0.1199
Trichomonas vaginalis	CMGC family protein kinase	0.0059	0.0337	0.1348
Brugia malayi	Protein kinase domain containing protein	0.0245	0.2911	0.2846
Onchocerca volvulus		0.0059	0.0337	0.5
Echinococcus multilocularis	serine threonine protein kinase	0.0046	0.016	0.0121
Trypanosoma cruzi	Protein kinase B	0.0084	0.0683	0.3862
Loa Loa (eye worm)	SRC-1	0.006	0.0345	0.0308

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 20 nM	Antiproliferative activity against human Molt3 cells	ChEMBL.	17482458
IC50 (functional)	= 20 nM	Antiproliferative activity against human Molt3 cells	ChEMBL.	17482458
IC50 (functional)	= 56 nM	Antiproliferative activity against human CEM cells	ChEMBL.	17482458
IC50 (functional)	= 56 nM	Antiproliferative activity against human CEM cells	ChEMBL.	17482458
IC50 (functional)	= 89 nM	Antiproliferative activity against human DND1 cells	ChEMBL.	17482458
IC50 (functional)	= 89 nM	Antiproliferative activity against human MCF7 cells	ChEMBL.	17482458
IC50 (functional)	= 89 nM	Antiproliferative activity against human MCF7 cells	ChEMBL.	17482458
IC50 (functional)	= 201 nM	Antiproliferative activity against human Bel7402 cells	ChEMBL.	17482458
IC50 (functional)	= 201 nM	Antiproliferative activity against human PC3 cells	ChEMBL.	17482458
IC50 (functional)	= 201 nM	Antiproliferative activity against human Bel7402 cells	ChEMBL.	17482458
IC50 (functional)	= 201 nM	Antiproliferative activity against human PC3 cells	ChEMBL.	17482458
IC50 (functional)	= 603 nM	Antiproliferative activity against human DU145 cells	ChEMBL.	17482458
IC50 (functional)	= 603 nM	Antiproliferative activity against human DU145 cells	ChEMBL.	17482458

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	17482458

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.

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External resources for this compound

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 441798