TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 852.059 | Formula: C45H73NO14
H donors: 6 H acceptors: 7 LogP: 5.59 Rotable bonds: 11
Rule of 5 violations (Lipinski): 3
SMILES: CC=C[C@H]1O[C@](O)(C[C@H]([C@@H]1C)O[C@H]1C[C@@H](O)[C@@H]([C@H](O1)C)OC(=O)N)[C@H](C(C([C@H]1OC(=O)C(=CC(=C[C@@H](C)[C@@H](O)[C@H]([C@H](C(CC(=CC=C[C@@H]1OC)C)C)O)C)C)OC)C)O)C
InChi: 1S/C45H73NO14/c1-13-15-33-27(6)36(57-37-21-32(47)42(31(10)56-37)59-44(46)52)22-45(53,60-33)30(9)40(50)29(8)41-34(54-11)17-14-16-23(2)18-25(4)38(48)28(7)39(49)26(5)19-24(3)20-35(55-12)43(51)58-41/h13-17,19-20,25-34,36-42,47-50,53H,18,21-22H2,1-12H3,(H2,46,52)/t25?,26-,27-,28+,29?,30+,31-,32-,33-,34+,36-,37+,38+,39-,40?,41-,42-,45-/m1/s1
InChiKey: AQXXGIBOZQZSAT-RSHNWWNKSA-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
Trichomonas vaginalis	conserved hypothetical protein	0.0033072	0.0213812	0.0884675
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	0.00465274	0.0438176	0.0620885
Schistosoma mansoni	vesicular amine transporter	0.00502299	0.0499914	0.139947
Echinococcus granulosus	macrophage colony stimulating factor 1 receptor	0.0439177	0.698546	1
Loa Loa (eye worm)	TK/ABL protein kinase	0.0229151	0.348336	0.348336
Brugia malayi	protein-tyrosine kinase	0.00440974	0.0397658	0.211295
Echinococcus multilocularis	cyclin dependent kinase 6	0.0232724	0.354295	1
Trichomonas vaginalis	cyclins, putative	0.0033072	0.0213812	0.0884675
Echinococcus granulosus	neuroglian	0.00558161	0.0593062	0.0842764
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.00440974	0.0397658	0.111047
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0115144	0.158233	0.84077
Plasmodium falciparum	protein kinase 5	0.00465274	0.0438176	1
Schistosoma mansoni	Neurotrimin precursor (hNT)	0.00502299	0.0499914	0.139947
Schistosoma mansoni	tyrosine kinase	0.0222072	0.336531	0.949796
Brugia malayi	Cyclin, N-terminal domain containing protein	0.00509714	0.0512278	0.272199
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.00342299	0.0233121	0.123869
Echinococcus multilocularis	neuroglian	0.00558161	0.0593062	0.166274
Brugia malayi	Cyclin, N-terminal domain containing protein	0.00509714	0.0512278	0.272199
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.00662762	0.0767481	0.21557
Schistosoma mansoni	serine/threonine protein kinase	0.0232724	0.354295	1
Schistosoma mansoni	metabotropic glutamate receptor 2 3 (mglur group 2)	0.00898228	0.116011	0.326539
Echinococcus multilocularis	cyclin B	0.00509714	0.0512278	0.143442
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0102328	0.136864	1
Trichomonas vaginalis	cyclin B, putative	0.00509714	0.0512278	0.324054
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.00901302	0.116524	0.619149
Echinococcus granulosus	cyclin dependent kinase 6	0.0232724	0.354295	0.506853
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0070282	0.0834276	0.578215
Giardia lamblia	Kinase, CMGC CDK	0.00465274	0.0438176	0.835663
Echinococcus granulosus	neurotracting:lsamp:neurotrimin:obcam	0.00573611	0.0618824	0.0879667
Onchocerca volvulus		0.00509714	0.0512278	0.5
Loa Loa (eye worm)	TK protein kinase	0.00440974	0.0397658	0.0397658
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.00992987	0.131812	0.956255
Brugia malayi	Protein kinase domain containing protein	0.00465274	0.0438176	0.232825
Brugia malayi	SRC-1	0.0051001	0.0512773	0.272462
Echinococcus granulosus	metabotropic glutamate receptor 2	0.00661743	0.0765781	0.109019
Echinococcus granulosus	basic fibroblast growth factor receptor 1 A	0.0109558	0.148918	0.212647
Entamoeba histolytica	cyclin, putative	0.00509714	0.0512278	0.258451
Trichomonas vaginalis	CMGC family protein kinase	0.00465274	0.0438176	0.265563
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.00440974	0.0397658	0.0562843
Schistosoma mansoni	tyrosine kinase	0.0109558	0.148918	0.419544
Echinococcus granulosus	cyclins	0.0033072	0.0213812	0.029948
Trypanosoma brucei	cdc2-related kinase 1	0.00465274	0.0438176	0.734551
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0102328	0.136864	1
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0192458	0.287152	0.410671
Trichomonas vaginalis	cyclin B, putative	0.00509714	0.0512278	0.324054
Giardia lamblia	Hypothetical protein	0.0033072	0.0213812	0.338091
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0033072	0.0213812	0.113609
Loa Loa (eye worm)	hypothetical protein	0.00446005	0.0406046	0.0406046
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.00453765	0.0418985	0.177666
Schistosoma mansoni	metabotropic glutamate receptor	0.00661743	0.0765781	0.215089
Trichomonas vaginalis	cyclin B, putative	0.0033072	0.0213812	0.0884675
Echinococcus multilocularis	cyclins	0.0033072	0.0213812	0.0590862
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0102328	0.136864	1
Echinococcus multilocularis	Immunoglobulin	0.00502299	0.0499914	0.139947
Loa Loa (eye worm)	hypothetical protein	0.00502299	0.0499914	0.0499914
Schistosoma mansoni	metabotropic glutamate receptor	0.0038504	0.0304388	0.0846858
Loa Loa (eye worm)	phosphatidylinositol 3	0.00312003	0.0182603	0.0182603
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.00342299	0.0233121	0.0167197
Echinococcus multilocularis	cyclins	0.0033072	0.0213812	0.0590862
Trichomonas vaginalis	cyclin B3, putative	0.0033072	0.0213812	0.0884675
Entamoeba histolytica	cell division protein kinase 2, putative	0.00465274	0.0438176	0.194284
Loa Loa (eye worm)	hypothetical protein	0.00360521	0.0263504	0.0263504
Echinococcus multilocularis	cyclin dependent kinase 1	0.00465274	0.0438176	0.122498
Echinococcus granulosus	defective proboscis extension response	0.00502299	0.0499914	0.0709326
Trypanosoma brucei	cdc2-related kinase 3	0.00465274	0.0438176	0.734551
Echinococcus multilocularis	tyrosine protein kinase ABL1	0.0229151	0.348336	0.983159
Echinococcus multilocularis	cyclin B3 1	0.0033072	0.0213812	0.0590862
Schistosoma mansoni	nephrin	0.00558161	0.0593062	0.166274
Loa Loa (eye worm)	hypothetical protein	0.00573611	0.0618824	0.0618824
Echinococcus multilocularis	roundabout 2	0.00629473	0.0711972	0.199881
Echinococcus multilocularis	basement membrane specific heparan sulfate	0.00502299	0.0499914	0.139947
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0051001	0.0512773	0.143581
Brugia malayi	Tyrosine-protein kinase abl-1	0.0102939	0.137882	0.732638
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.00662762	0.0767481	0.407801
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.0051001	0.0512773	0.143581
Loa Loa (eye worm)	glutamate receptor	0.00310762	0.0180534	0.0180534
Entamoeba histolytica	cell division protein kinase 2, putative	0.00465274	0.0438176	0.194284
Echinococcus multilocularis	basic fibroblast growth factor receptor 1 A	0.0109558	0.148918	0.419544
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.00662762	0.0767481	0.109262
Echinococcus granulosus	tyrosine kinase	0.00440974	0.0397658	0.0562843
Echinococcus granulosus	tyrosine protein kinase Lyn	0.00529279	0.0544902	0.0773773
Echinococcus granulosus	tyrosine protein kinase Src64B	0.0051001	0.0512773	0.0727747
Entamoeba histolytica	hypothetical protein	0.00814286	0.102014	0.698226
Brugia malayi	metabotropic glutamate receptor subtype 5a (mGluR5a), putative	0.00715682	0.0855723	0.454688
Echinococcus multilocularis	tyrosine protein kinase Abl	0.0102939	0.137882	0.388354
Echinococcus multilocularis	fibroblast growth factor receptor 4	0.0109558	0.148918	0.419544
Echinococcus granulosus	cyclin B3 1	0.0033072	0.0213812	0.029948
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.00465274	0.0438176	0.0438176
Echinococcus granulosus	twitchin	0.0057743	0.0625192	0.088879
Loa Loa (eye worm)	CAMK/CAMKL/NUAK protein kinase	0.0619963	1	1
Giardia lamblia	Kinase, CMGC CDK	0.00465274	0.0438176	0.835663
Loa Loa (eye worm)	TK protein kinase	0.00370181	0.0279613	0.0279613
Brugia malayi	Fibronectin type III domain containing protein	0.00502299	0.0499914	0.265629
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0102328	0.136864	0.727225
Schistosoma mansoni	tyrosine kinase	0.0051001	0.0512773	0.143581
Loa Loa (eye worm)	hypothetical protein	0.00502299	0.0499914	0.0499914
Trichomonas vaginalis	cyclins, putative	0.00509714	0.0512278	0.324054
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.00342299	0.0233121	0.0425935
Echinococcus granulosus	cyclins	0.0033072	0.0213812	0.029948
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0051001	0.0512773	0.143581
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0070282	0.0834276	0.578215
Schistosoma mansoni	serine/threonine protein kinase	0.00465274	0.0438176	0.122498
Trichomonas vaginalis	cyclin D, putative	0.0033072	0.0213812	0.0884675
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0051001	0.0512773	0.143581
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.0051001	0.0512773	0.143581
Trypanosoma cruzi	cdc2-related kinase 3	0.00465274	0.0438176	0.215485
Loa Loa (eye worm)	hypothetical protein	0.00502299	0.0499914	0.0499914
Echinococcus granulosus	metabotropic glutamate receptor 5	0.00972505	0.128397	0.18325
Trypanosoma brucei	mitotic cyclin 6	0.00509714	0.0512278	1
Loa Loa (eye worm)	hypothetical protein	0.00502299	0.0499914	0.0499914
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.00375459	0.0288412	0.0801705
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.0051001	0.0512773	0.143581
Loa Loa (eye worm)	hypothetical protein	0.00629473	0.0711972	0.0711972
Trypanosoma cruzi	cdc2-related kinase 1	0.00465274	0.0438176	0.215485
Echinococcus granulosus	cyclin B	0.00509714	0.0512278	0.0727038
Echinococcus multilocularis	cyclins	0.0033072	0.0213812	0.0590862
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0102328	0.136864	1
Trichomonas vaginalis	cyclin D, putative	0.0033072	0.0213812	0.0884675
Brugia malayi	metabotropic glutamate receptor type 2	0.0038504	0.0304388	0.161737
Echinococcus multilocularis	cyclin dependent kinase 1	0.00465274	0.0438176	0.122498
Loa Loa (eye worm)	TK protein kinase	0.0115144	0.158233	0.158233
Loa Loa (eye worm)	hypothetical protein	0.00502299	0.0499914	0.0499914
Echinococcus multilocularis	metabotropic glutamate receptor 2	0.00661743	0.0765781	0.215089
Echinococcus granulosus	tyrosine protein kinase Src42A	0.00375459	0.0288412	0.0406347
Echinococcus granulosus	cyclin dependent kinase	0.00465274	0.0438176	0.0620885
Loa Loa (eye worm)	hypothetical protein	0.00889563	0.114566	0.114566
Trichomonas vaginalis	cyclins, putative	0.00509714	0.0512278	0.324054
Echinococcus granulosus	cyclins	0.0033072	0.0213812	0.029948
Schistosoma mansoni	cyclin B	0.00509714	0.0512278	0.143442
Brugia malayi	cell division control protein 2 homolog	0.00465274	0.0438176	0.232825
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.00342299	0.0233121	0.0167197
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.0051001	0.0512773	0.143581
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.0051001	0.0512773	0.143581
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.00493823	0.048578	0.941236
Trypanosoma cruzi	cdc2-related kinase 1	0.00465274	0.0438176	0.215485
Echinococcus multilocularis	cyclin dependent kinase	0.00465274	0.0438176	0.122498
Echinococcus multilocularis	cyclins	0.0033072	0.0213812	0.0590862
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.0051001	0.0512773	0.0727747
Brugia malayi	Metabotropic glutamate receptor precursor.	0.00789959	0.0979577	0.520498
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0051001	0.0512773	0.0727747
Trypanosoma cruzi	cyclin 6, putative	0.00509714	0.0512278	0.277964
Echinococcus granulosus	cyclin dependent kinase 5	0.00465274	0.0438176	0.0620885
Echinococcus multilocularis	tyrosine protein kinase Blk	0.00440974	0.0397658	0.111047
Loa Loa (eye worm)	hypothetical protein	0.00509714	0.0512278	0.0512278
Plasmodium vivax	protein kinase Crk2	0.00465274	0.0438176	0.5
Brugia malayi	Immunoglobulin I-set domain containing protein	0.00639126	0.0728069	0.386859
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.00342299	0.0233121	0.103708
Echinococcus granulosus	cyclins	0.0033072	0.0213812	0.029948
Trichomonas vaginalis	cyclin B, putative	0.00509714	0.0512278	0.324054
Echinococcus granulosus	fibroblast growth factor receptor 4	0.0109558	0.148918	0.212647
Echinococcus granulosus	tyrosine protein kinase ABL1	0.0229151	0.348336	0.498317
Echinococcus multilocularis	cyclin b3	0.0033072	0.0213812	0.0590862
Trichomonas vaginalis	cyclins, putative	0.00509714	0.0512278	0.324054
Loa Loa (eye worm)	hypothetical protein	0.00662762	0.0767481	0.0767481
Echinococcus multilocularis	G2:mitotic specific cyclin B3	0.0033072	0.0213812	0.0590862
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0051001	0.0512773	0.0727747
Echinococcus granulosus	roundabout 2	0.00629473	0.0711972	0.10131
Schistosoma mansoni	cyclin B3	0.0033072	0.0213812	0.0590862
Echinococcus multilocularis	cyclins	0.0033072	0.0213812	0.0590862
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0051001	0.0512773	0.143581
Echinococcus granulosus	cyclin dependent kinase 1	0.00465274	0.0438176	0.0620885
Loa Loa (eye worm)	hypothetical protein	0.00972505	0.128397	0.128397
Trypanosoma cruzi	cyclin, putative	0.00509714	0.0512278	0.277964
Trypanosoma cruzi	cdc2-related kinase 3	0.00465274	0.0438176	0.215485
Brugia malayi	Immunoglobulin I-set domain containing protein	0.00502299	0.0499914	0.265629
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0051001	0.0512773	0.0727747
Echinococcus multilocularis	tyrosine protein kinase Srms	0.00440974	0.0397658	0.111047
Loa Loa (eye worm)	glutamate receptor	0.00789959	0.0979577	0.0979577
Giardia lamblia	G2/mitotic-specific cyclin B	0.00509714	0.0512278	1
Echinococcus granulosus	cyclins	0.0033072	0.0213812	0.029948
Entamoeba histolytica	protein kinase, putative	0.00370181	0.0279613	0.0569786
Loa Loa (eye worm)	phosphatidylinositol 3	0.0171559	0.252303	0.252303
Echinococcus granulosus	Immunoglobulin	0.00502299	0.0499914	0.0709326
Trypanosoma cruzi	CYC2-like cyclin, putative	0.00509714	0.0512278	0.277964
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0192458	0.287152	0.810236
Schistosoma mansoni	serine/threonine protein kinase	0.00465274	0.0438176	0.122498
Loa Loa (eye worm)	hypothetical protein	0.00502299	0.0499914	0.0499914
Trichomonas vaginalis	CMGC family protein kinase	0.00465274	0.0438176	0.265563
Brugia malayi	hypothetical protein	0.00502299	0.0499914	0.265629
Echinococcus granulosus	G2:mitotic specific cyclin B3	0.0033072	0.0213812	0.029948
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.00342299	0.0233121	0.103708
Loa Loa (eye worm)	SRC-1	0.0051001	0.0512773	0.0512773
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.00639126	0.0728069	0.0728069
Echinococcus multilocularis	cyclins	0.0033072	0.0213812	0.0590862
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0102328	0.136864	1
Echinococcus granulosus	tyrosine protein kinase Blk	0.00440974	0.0397658	0.0562843
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.0051001	0.0512773	0.0727747
Echinococcus multilocularis	cyclin dependent kinase 5	0.00465274	0.0438176	0.122498
Trichomonas vaginalis	CMGC family protein kinase	0.00465274	0.0438176	0.265563
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	0.00465274	0.0438176	0.0438176
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.00814286	0.102014	0.698226
Trypanosoma cruzi	cyclin, putative	0.00509714	0.0512278	0.277964
Schistosoma mansoni	defective proboscis extension response (dpr)-related	0.00502299	0.0499914	0.139947
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.00342299	0.0233121	0.0645433
Toxoplasma gondii	cell-cycle-associated protein kinase CDK, putative	0.00465274	0.0438176	1
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	0.00509714	0.0512278	1
Loa Loa (eye worm)	cyclin domain-containing protein	0.0033072	0.0213812	0.0213812
Giardia lamblia	Cyclin A	0.0033072	0.0213812	0.338091
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.00465274	0.0438176	0.0438176
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.00342299	0.0233121	0.103708
Echinococcus granulosus	cyclin b3	0.0033072	0.0213812	0.029948
Echinococcus multilocularis	tyrosine protein kinase HCK	0.00370181	0.0279613	0.0776834
Loa Loa (eye worm)	hypothetical protein	0.00629473	0.0711972	0.0711972
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0051001	0.0512773	0.0727747
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0102328	0.136864	1
Trichomonas vaginalis	cyclin A, putative	0.00509714	0.0512278	0.324054
Brugia malayi	Tyrosine-protein kinase abl-1	0.0133115	0.1882	1
Echinococcus multilocularis	Immunoglobulin	0.00502299	0.0499914	0.139947
Trichomonas vaginalis	cyclin B, putative	0.00509714	0.0512278	0.324054
Echinococcus multilocularis	metabotropic glutamate receptor 5	0.00972505	0.128397	0.361544
Leishmania major	cyclin	0.00509714	0.0512278	1
Schistosoma mansoni	cyclins	0.0033072	0.0213812	0.0590862
Schistosoma mansoni	cell adhesion molecule	0.00573611	0.0618824	0.173555
Schistosoma mansoni	tyrosine kinase	0.0051001	0.0512773	0.143581
Echinococcus multilocularis	cyclins	0.0033072	0.0213812	0.0590862
Echinococcus granulosus	tyrosine protein kinase HCK	0.00370181	0.0279613	0.0393741
Trichomonas vaginalis	cyclins, putative	0.00509714	0.0512278	0.324054
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0192458	0.287152	0.810236
Loa Loa (eye worm)	hypothetical protein	0.00509714	0.0512278	0.0512278

Activities

Activity type	Activity value	Assay description	Source	Reference
CC50	> 10 uM	NOVARTIS: Cytotoxicity against human hepatocellular carcinoma cell line (Huh7)	ChEMBL.	18579783
EC50 (functional)	= 0.2401 uM	NOVARTIS: Inhibition of Plasmodium falciparum W2 (drug-resistant) proliferation in erythrocyte-based infection assay	ChEMBL.	18579783
EC50 (functional)	> 1.672 uM	NOVARTIS: Inhibition of Plasmodium falciparum 3D7 (drug-susceptible) proliferation in erythrocyte-based infection assay	ChEMBL.	18579783

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23	18579783

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

ChEMBL: CHEMBL1744502

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1526977