TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 998.086 | Formula: C47H67N9O15
H donors: 13 H acceptors: 15 LogP: -2.47 Rotable bonds: 38
Rule of 5 violations (Lipinski): 4
SMILES: CC(C[C@@H](C(=O)N[C@@H]([C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CCC(=O)O)C)CC(=O)N)O)Cc1ccccc1)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCC(=O)O)N)C
InChi: 1S/C47H67N9O15/c1-24(2)20-32(53-45(68)38(25(3)4)56-41(64)29(48)16-18-36(58)59)44(67)52-31(21-27-12-8-6-9-13-27)39(62)46(69)54-33(23-35(49)57)43(66)50-26(5)40(63)51-30(17-19-37(60)61)42(65)55-34(47(70)71)22-28-14-10-7-11-15-28/h6-15,24-26,29-34,38-39,62H,16-23,48H2,1-5H3,(H2,49,57)(H,50,66)(H,51,63)(H,52,67)(H,53,68)(H,54,69)(H,55,65)(H,56,64)(H,58,59)(H,60,61)(H,70,71)/t26-,29-,30-,31+,32-,33-,34-,38-,39+/m0/s1
InChiKey: LQYUYMZEHJAEKX-VQWILANRSA-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	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Toxoplasma gondii	CMGC kinase, CK2 family	0.0138	0.0727	0.6526
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0064	0.0269	0.2328
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0098	0.0482	0.1359
Trichomonas vaginalis	AGC family protein kinase	0.007	0.0308	0.2666
Entamoeba histolytica	casein kinase, putative	0.0138	0.0727	0.6264
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0064	0.0269	0.2328
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0114	0.0577	0.1625
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0022	0.0007	0.0063
Trichomonas vaginalis	CMGC family protein kinase	0.0138	0.0727	0.6286
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0022	0.0007	0.0007
Schistosoma mansoni	glycogen synthase kinase 3-related (gsk3) (cmgc group III)	0.0111	0.0562	0.7533
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0114	0.0577	0.169
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Echinococcus multilocularis		0.0022	0.0007	0.0007
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0022	0.0007	0.0061
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0071	0.0315	0.2721
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0114	0.0577	0.4987
Onchocerca volvulus		0.0057	0.0225	0.1385
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0114	0.0577	0.0577
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0064	0.0269	0.1539
Echinococcus granulosus	protein kinase C gamma type	0.007	0.0308	0.0308
Trichomonas vaginalis	conserved hypothetical protein	0.0042	0.0134	0.1154
Loa Loa (eye worm)	phosphatidylinositol 3	0.0114	0.0577	0.3297
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Entamoeba histolytica	protein kinase domain containing protein	0.0138	0.0727	0.6264
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0022	0.0007	0.0061
Entamoeba histolytica	protein kinase, putative	0.0207	0.1157	1
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.0064	0.0269	0.2281
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0054	0.0309
Echinococcus multilocularis	rac serine:threonine kinase	0.0141	0.0746	0.0746
Schistosoma mansoni	serine/threonine kinase	0.007	0.0308	0.4136
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0022	0.0007	0.0061
Echinococcus granulosus	tumor protein p63	0.0389	0.2289	0.2289
Echinococcus multilocularis	glutaminyl peptide cyclotransferase	0.013	0.068	0.068
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0064	0.0269	0.0789
Echinococcus multilocularis	serine:threonine protein kinase N2	0.007	0.0308	0.0308
Leishmania major	casein kinase II, putative	0.0138	0.0727	0.2049
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0114	0.0577	0.0577
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0022	0.0007	0.0021
Trichomonas vaginalis	AGC family protein kinase	0.0077	0.0351	0.3034
Entamoeba histolytica	casein kinase II regulatory subunit family protein	0.0037	0.0099	0.0799
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0114	0.0577	0.1625
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0022	0.0007	0.0063
Schistosoma mansoni	phosphatidylinositol 4-kinase type-II	0.0022	0.0007	0.0095
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0064	0.0269	0.2328
Toxoplasma gondii	FATC domain-containing protein	0.0064	0.0269	0.2416
Trichomonas vaginalis	CAMK family protein kinase	0.0098	0.0482	0.417
Echinococcus multilocularis	protein kinase c iota type	0.007	0.0308	0.0308
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0022	0.0007	0.004
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0022	0.0007	0.0063
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0022	0.0007	0.004
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Onchocerca volvulus	Glutaminyl cyclase homolog	0.013	0.068	0.4182
Trichomonas vaginalis	CMGC family protein kinase	0.0138	0.0727	0.6286
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0064	0.0269	0.2328
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.0134	0.0703	0.0703
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0114	0.0577	0.7737
Schistosoma mansoni	cellular tumor antigen P53	0.0057	0.0225	0.302
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0022	0.0007	0.0021
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0007	0.004
Loa Loa (eye worm)	hypothetical protein	0.013	0.068	0.3886
Plasmodium vivax	casein kinase II beta chain, putative	0.0037	0.0099	0.1275
Echinococcus granulosus	casein kinase ii subunit beta	0.0037	0.0099	0.0099
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0022	0.0007	0.0061
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0022	0.0007	0.0007
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Loa Loa (eye worm)	phosphatidylinositol 3	0.0022	0.0007	0.004
Toxoplasma gondii	casein kinase ii regulatory subunit protein	0.0037	0.0099	0.0887
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0022	0.0007	0.0061
Echinococcus multilocularis	nervana 2	0.013	0.0677	0.0677
Trichomonas vaginalis	CMGC family protein kinase	0.0138	0.0727	0.6286
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0022	0.0007	0.0021
Echinococcus granulosus	protein kinase c epsilon type	0.007	0.0308	0.0308
Onchocerca volvulus	Casein kinase II subunit beta homolog	0.0037	0.0099	0.0608
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Echinococcus granulosus	Glutaredoxin protein 5	0.013	0.0677	0.0677
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0064	0.0269	0.2328
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Toxoplasma gondii	ck2 beta subunit	0.0037	0.0099	0.0887
Schistosoma mansoni	serine/threonine protein kinase	0.007	0.0308	0.4136
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Schistosoma mansoni	cell adhesion molecule	0.0025	0.0025	0.033
Echinococcus granulosus	glutaminyl peptide cyclotransferase	0.013	0.068	0.068
Plasmodium vivax	casein kinase 2, alpha subunit, putative	0.0138	0.0727	1
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0141	0.0746	0.6425
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Echinococcus multilocularis	Zinc finger, PHD finger	0.0022	0.0007	0.0007
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0022	0.0007	0.0021
Echinococcus granulosus	serine:threonine protein kinase N2	0.007	0.0308	0.0308
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Trichomonas vaginalis	AGC family protein kinase	0.0207	0.1157	1
Plasmodium vivax	glycogen synthase kinase 3, putative	0.0111	0.0562	0.7703
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0022	0.0007	0.0061
Echinococcus granulosus	glycogen synthase kinase 3 beta	0.0111	0.0562	0.0562
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0302	0.175	1
Giardia lamblia	Kinase, CMGC GSK	0.0111	0.0562	0.7703
Entamoeba histolytica	protein kinase 2, putative	0.0134	0.0703	0.6055
Trypanosoma brucei	rac serine-threonine kinase, putative	0.0207	0.1157	1
Plasmodium falciparum	glycogen synthase kinase 3	0.0111	0.0562	0.7703
Leishmania major	glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270	0.0111	0.0562	0.1583
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0064	0.0269	0.0789
Echinococcus granulosus	phosphatidylinositol 4 kinase beta	0.0022	0.0007	0.0007
Brugia malayi	protein kinase C II.	0.007	0.0308	0.1762
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0111	0.0562	0.321
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0114	0.0577	0.1625
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0022	0.0007	0.004
Brugia malayi	serine/threonine-protein kinase plk-2	0.0098	0.0482	0.2756
Echinococcus granulosus	nervana 2	0.013	0.0677	0.0677
Echinococcus granulosus	twitchin	0.0028	0.0043	0.0043
Echinococcus multilocularis	protein kinase c epsilon type	0.007	0.0308	0.0308
Schistosoma mansoni	serine/threonine protein kinase	0.007	0.0308	0.4136
Echinococcus multilocularis	serine threonine protein kinase	0.007	0.0308	0.0308
Loa Loa (eye worm)	phosphatidylinositol 3	0.0114	0.0577	0.3297
Loa Loa (eye worm)	phosphatidylinositol 3	0.0022	0.0007	0.004
Onchocerca volvulus	Tyrosine kinase homolog	0.0282	0.1626	1
Trypanosoma cruzi	polo-like protein kinase, putative	0.0098	0.0482	0.1413
Entamoeba histolytica	casein kinase II regulatory subunit family protein	0.0037	0.0099	0.0799
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0114	0.0577	0.169
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0007	0.004
Trypanosoma brucei	phosphatidylinositol 3-kinase catalytic subunit, putative	0.0022	0.0007	0.0061
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0022	0.0007	0.0061
Trypanosoma cruzi	Casein kinase II subunit beta, putative	0.0037	0.0099	0.029
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0022	0.0007	0.0095
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.007	0.0308	0.0308
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0114	0.0577	0.4987
Trichomonas vaginalis	AGC family protein kinase	0.007	0.0308	0.2666
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0022	0.0007	0.0061
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.007	0.0308	0.1762
Echinococcus multilocularis	serine:threonine protein kinase N2	0.007	0.0308	0.0308
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0022	0.0007	0.0021
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Echinococcus multilocularis	protein kinase shaggy	0.0111	0.0562	0.0562
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0022	0.0007	0.0021
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0022	0.0007	0.002
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0207	0.1157	0.661
Plasmodium falciparum	casein kinase II beta chain	0.0037	0.0099	0.1275
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.0134	0.0703	0.0703
Entamoeba histolytica	hypothetical protein	0.0064	0.0269	0.2281
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0022	0.0007	0.0007
Trypanosoma brucei	Casein kinase II subunit beta, putative	0.0037	0.0099	0.0855
Mycobacterium leprae	conserved hypothetical protein	0.0022	0.0007	0.5
Plasmodium vivax	casein kinase II beta chain, putative	0.0037	0.0099	0.1275
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0064	0.0269	0.2328
Trichomonas vaginalis	CAMK family protein kinase	0.0098	0.0482	0.417
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0022	0.0007	0.0007
Plasmodium vivax	unspecified product	0.0138	0.0727	1
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0098	0.0482	0.0482
Echinococcus multilocularis	glycogen synthase kinase 3 beta	0.0111	0.0562	0.0562
Plasmodium falciparum	RAC-beta serine/threonine protein kinase	0.0134	0.0703	0.9667
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.005	0.0179	0.0179
Schistosoma mansoni	phosphatidylinositol 3-kinase class	0.0022	0.0007	0.0095
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Leishmania major	hypothetical protein, conserved	0.0592	0.355	1
Giardia lamblia	Casein kinase II beta chain	0.0037	0.0099	0.1275
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Trypanosoma cruzi	glycogen synthase kinase 3, putative	0.0111	0.0562	0.1646
Echinococcus multilocularis	nervana 2	0.013	0.0677	0.0677
Schistosoma mansoni	serine/threonine protein kinase	0.0098	0.0482	0.6468
Trypanosoma cruzi	target of rapamycin kinase 3	0.0114	0.0577	0.169
Trypanosoma cruzi	phosphatidylinositol kinase, putative	0.0022	0.0007	0.0021
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0022	0.0007	0.0061
Schistosoma mansoni	serine/threonine protein kinase	0.007	0.0308	0.4136
Schistosoma mansoni	fkbp-rapamycin associated protein	0.0064	0.0269	0.3611
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0022	0.0007	0.004
Trichomonas vaginalis	AGC family protein kinase	0.0207	0.1157	1
Mycobacterium ulcerans	lipoprotein aminopeptidase LpqL	0.0021	0	0.5
Echinococcus multilocularis	casein kinase ii subunit alpha	0.0138	0.0727	0.0727
Trichomonas vaginalis	CAMK family protein kinase	0.0098	0.0482	0.417
Trypanosoma brucei	Casein kinase II	0.0138	0.0727	0.6286
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0022	0.0007	0.0061
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0022	0.0007	0.0007
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0022	0.0007	0.0063
Schistosoma mansoni	nephrin	0.0023	0.0016	0.022
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0098	0.0482	0.0482
Giardia lamblia	Kinase, CMGC GSK	0.0111	0.0562	0.7703
Trichomonas vaginalis	AGC family protein kinase	0.0207	0.1157	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Trichomonas vaginalis	CMGC family protein kinase	0.0138	0.0727	0.6286
Giardia lamblia	GTOR	0.0114	0.0577	0.7913
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0022	0.0007	0.0095
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0141	0.0746	0.6425
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0022	0.0007	0.0061
Brugia malayi	Protein kinase domain containing protein	0.007	0.0308	0.1762
Entamoeba histolytica	protein kinase, putative	0.0207	0.1157	1
Echinococcus granulosus	protein kinase c iota type	0.007	0.0308	0.0308
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.007	0.0308	0.0308
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0114	0.0577	0.7737
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0022	0.0007	0.0061
Brugia malayi	FAT domain containing protein	0.005	0.0179	0.1023
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0042	0.0134	0.0391
Onchocerca volvulus		0.0276	0.1586	0.9754
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0022	0.0007	0.0007
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.007	0.0308	0.1762
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0022	0.0007	0.0021
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0022	0.0007	0.004
Echinococcus granulosus	neuroglian	0.0023	0.0016	0.0016
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0022	0.0007	0.0063
Loa Loa (eye worm)	hypothetical protein	0.005	0.0179	0.1023
Trichomonas vaginalis	CAMK family protein kinase	0.0098	0.0482	0.417
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0022	0.0007	0.0021
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Trichomonas vaginalis	CMGC family protein kinase	0.0111	0.0562	0.4856
Leishmania major	protein kinase ck2 regulatory subunit, putative	0.0037	0.0099	0.0279
Trichomonas vaginalis	AGC family protein kinase	0.0207	0.1157	1
Schistosoma mansoni	casein kinase II beta subunit	0.0037	0.0099	0.1326
Trichomonas vaginalis	AGC family protein kinase	0.007	0.0308	0.2666
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.007	0.0308	0.0308
Echinococcus granulosus	roundabout 2	0.0029	0.0054	0.0054
Onchocerca volvulus		0.0111	0.0562	0.3454
Trichomonas vaginalis	conserved hypothetical protein	0.005	0.0179	0.1547
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0022	0.0007	0.0007
Brugia malayi	Protein kinase domain containing protein	0.0207	0.1157	0.661
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0022	0.0007	1
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0114	0.0577	0.4987
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0315	0.1798
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0114	0.0577	0.4957
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.0071	0.0315	0.2824
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.02	0.1114	0.6367
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0134	0.0763
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.007	0.0308	0.0308
Echinococcus granulosus	protein kinase shaggy	0.0111	0.0562	0.0562
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0114	0.0577	0.1625
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.007	0.0308	0.1762
Echinococcus multilocularis	Glutaredoxin protein 5	0.013	0.0677	0.0677
Toxoplasma gondii	AGC kinase	0.02	0.1114	1
Trichomonas vaginalis	CAMK family protein kinase	0.0098	0.0482	0.417
Plasmodium falciparum	casein kinase 2, alpha subunit	0.0138	0.0727	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0064	0.0269	0.2328
Trypanosoma brucei	protein kinase, putative	0.0111	0.0562	0.4856
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.005	0.0179	0.0179
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Trichomonas vaginalis	CMGC family protein kinase	0.0138	0.0727	0.6286
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0114	0.0577	0.3297
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0022	0.0007	0.0061
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Entamoeba histolytica	protein kinase, putative	0.007	0.0308	0.2621
Plasmodium falciparum	casein kinase II beta chain	0.0037	0.0099	0.1275
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.163	1	1
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0269	0.1539
Schistosoma mansoni	atypical protein kinase C	0.007	0.0308	0.4136
Leishmania major	phosphatidylinositol kinase related protein, putative	0.0022	0.0007	0.002
Echinococcus granulosus	casein kinase ii subunit alpha	0.0138	0.0727	0.0727
Brugia malayi	Casein kinase II, alpha chain	0.0138	0.0727	0.4155
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0114	0.0577	0.169
Trichomonas vaginalis	AGC family protein kinase	0.0207	0.1157	1
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0114	0.0577	0.0577
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0022	0.0007	0.0061
Loa Loa (eye worm)	phosphatidylinositol 3	0.0022	0.0007	0.004
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Plasmodium vivax	rac-beta serine/threonine protein kinase, putative	0.0134	0.0703	0.9667
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0064	0.0269	0.3611
Loa Loa (eye worm)	Csnk2b protein	0.0037	0.0099	0.0565
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0302	0.175	1
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0022	0.0007	0.002
Trypanosoma cruzi	hypothetical protein, conserved	0.057	0.3414	1
Trichomonas vaginalis	CAMK family protein kinase	0.0051	0.0186	0.1608
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0022	0.0007	0.0061
Toxoplasma gondii	cell-cycle-associated protein kinase GSK, putative	0.0111	0.0562	0.5041
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0022	0.0007	0.0095
Schistosoma mansoni	serine/threonine protein kinase	0.007	0.0308	0.4136
Schistosoma mansoni	protein kinase	0.0138	0.0727	0.9752
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0111	0.0562	0.321
Trichomonas vaginalis	CAMK family protein kinase	0.0098	0.0482	0.417
Entamoeba histolytica	protein kinase rad3, putative	0.0064	0.0269	0.2281
Schistosoma mansoni	serine/threonine protein kinase	0.007	0.0308	0.4136
Giardia lamblia	Kinase, AGC PKA	0.0134	0.0703	0.9667
Onchocerca volvulus	Casein kinase II subunit beta homolog	0.0037	0.0099	0.0608
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0022	0.0007	0.0021
Trypanosoma cruzi	polo-like protein kinase, putative	0.0098	0.0482	0.1413
Schistosoma mansoni	glutaminyl cyclase (M28 family)	0.013	0.068	0.912
Entamoeba histolytica	serine/threonine protein kinase, putative	0.0098	0.0482	0.4134
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0022	0.0007	0.0007
Onchocerca volvulus	Serine\/threonine kinase homolog	0.0098	0.0482	0.2966
Echinococcus multilocularis	tumor protein p63	0.0389	0.2289	0.2289
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0114	0.0577	0.169
Entamoeba histolytica	protein kinase, putative	0.0111	0.0562	0.4825
Echinococcus granulosus	serine threonine protein kinase nrc	0.0134	0.0703	0.0703
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Brugia malayi	Hr1 repeat family protein	0.007	0.0308	0.1762
Entamoeba histolytica	casein kinase II regulatory subunit family protein	0.0037	0.0099	0.0799
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0114	0.0577	0.5177
Trypanosoma cruzi	casein kinase II, putative	0.0138	0.0727	0.213
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0022	0.0007	0.0007
Echinococcus multilocularis	casein kinase ii subunit beta	0.0037	0.0099	0.0099
Loa Loa (eye worm)	CMGC/CK2 protein kinase	0.0138	0.0727	0.4155
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0.0562	0.4825
Entamoeba histolytica	protein kinase, putative	0.02	0.1114	0.9631
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0064	0.0269	0.1539
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0114	0.0577	0.3297
Trichomonas vaginalis	CAMK family protein kinase	0.0051	0.0186	0.1608
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0022	0.0007	0.004
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0134	0.0703	0.206
Echinococcus multilocularis	neuroglian	0.0023	0.0016	0.0016
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Trichomonas vaginalis	conserved hypothetical protein	0.0071	0.0315	0.2721
Trichomonas vaginalis	CMGC family protein kinase	0.0138	0.0727	0.6286
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0025	0.0141
Echinococcus multilocularis	serine:threonine protein kinase 38	0.007	0.0308	0.0308
Trichomonas vaginalis	CMGC family protein kinase	0.0138	0.0727	0.6286
Loa Loa (eye worm)	AGC/NDR protein kinase	0.007	0.0308	0.1762
Echinococcus multilocularis	roundabout 2	0.0029	0.0054	0.0054
Brugia malayi	p70 ribosomal S6 kinase beta	0.02	0.1114	0.6367
Loa Loa (eye worm)	hypothetical protein	0.007	0.0308	0.1762
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0114	0.0577	0.4957
Schistosoma mansoni	serine/threonine protein kinase	0.007	0.0308	0.4136
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Echinococcus granulosus	serine protein kinase ATM	0.0064	0.0269	0.0269
Loa Loa (eye worm)	phosphatidylinositol kinase	0.0022	0.0007	0.004
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0114	0.0577	0.0577
Trypanosoma cruzi	Protein kinase B	0.0141	0.0746	0.2184
Onchocerca volvulus		0.0022	0.0007	0.0043
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0022	0.0007	0.004
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0114	0.0577	0.4987
Trichomonas vaginalis	CMGC family protein kinase	0.0111	0.0562	0.4856
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.0064	0.0269	0.0269
Giardia lamblia	Kinase, PLK	0.0098	0.0482	0.66
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Brugia malayi	Csnk2b protein	0.0037	0.0099	0.0565
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0064	0.0269	0.2328
Leishmania major	phosphatidylinositol 4-kinase, putative	0.0022	0.0007	0.002
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.0064	0.0269	0.0269
Loa Loa (eye worm)	phosphatidylinositol 3	0.0022	0.0007	0.004
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0022	0.0007	0.0061
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0022	0.0007	0.0061
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	0.013	0.0677	0.0677
Schistosoma mansoni	hypothetical protein	0.0022	0.0007	0.0095
Leishmania major	phosphatidylinositol kinase, putative	0.0022	0.0007	0.002
Trypanosoma brucei	polo-like protein kinase	0.0098	0.0482	0.417
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0054	0.0309
Schistosoma mansoni	kinase	0.0052	0.0194	0.2598
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0114	0.0577	0.4987
Schistosoma mansoni	hypothetical protein	0.005	0.0179	0.24
Echinococcus granulosus	Protein kinase C brain isozyme	0.007	0.0308	0.0308
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0022	0.0007	0.004
Loa Loa (eye worm)	hypothetical protein	0.0057	0.0225	0.1287
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Echinococcus multilocularis	serine protein kinase ATM	0.0064	0.0269	0.0269
Echinococcus granulosus	NDR protein kinase	0.007	0.0308	0.0308
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0022	0.0007	0.0095
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0064	0.0269	0.2328
Mycobacterium ulcerans	hypothetical protein	0.0021	0	0.5
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0022	0.0007	0.0061
Trichomonas vaginalis	AGC family protein kinase	0.0207	0.1157	1
Brugia malayi	Peptidase family M28 containing protein	0.013	0.068	0.3886
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0141	0.0746	0.2184
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0042	0.0134	0.1154
Loa Loa (eye worm)	AGC/PKN protein kinase	0.007	0.0308	0.1762
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0071	0.0315	0.2721
Echinococcus granulosus	serine/threonine protein kinase	0.0141	0.0746	0.0746
Trichomonas vaginalis	casein kinase II beta chain, putative	0.0037	0.0099	0.0855
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.007	0.0308	0.0308
Brugia malayi	intracellular kinase	0.0111	0.0562	0.321
Entamoeba histolytica	protein kinase domain containing protein	0.0111	0.0562	0.4825
Onchocerca volvulus		0.0022	0.0007	0.0043
Loa Loa (eye worm)	phosphatidylinositol 3	0.0022	0.0007	0.004
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0098	0.0482	0.2756
Schistosoma mansoni	serine/threonine-protein kinase	0.0141	0.0746	1
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0022	0.0007	0.0095
Brugia malayi	Protein kinase domain containing protein	0.007	0.0308	0.1762
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0022	0.0007	0.0007
Schistosoma mansoni	serine/threonine-protein kinase	0.0141	0.0746	1
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.007	0.0308	0.0308
Giardia lamblia	Kinase, CMGC CK2	0.0138	0.0727	1
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0022	0.0007	0.0061
Schistosoma mansoni	serine/threonine protein kinase	0.007	0.0308	0.4136
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	0.013	0.0677	0.0677
Trypanosoma cruzi	Casein kinase II subunit beta, putative	0.0037	0.0099	0.029
Echinococcus granulosus	neurotracting:lsamp:neurotrimin:obcam	0.0025	0.0025	0.0025
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0114	0.0577	0.1625
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.007	0.0308	0.0308
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.007	0.0308	0.1762
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0114	0.0577	0.4987
Trichomonas vaginalis	CAMK family protein kinase	0.0098	0.0482	0.417
Echinococcus granulosus	nervana 2	0.013	0.0677	0.0677
Leishmania major	hypothetical protein, unknown function	0.0022	0.0007	0.002
Trichomonas vaginalis	serine/threonine-protein kinase sgk, putative	0.0066	0.0282	0.2441
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0022	0.0007	0.0007
Trichomonas vaginalis	AGC family protein kinase	0.0207	0.1157	1
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0022	0.0007	0.0061

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (binding)	= 22 %	Inhibition of beta-secretase 1 (BACE) was determined at the concentration of 2 uM	ChEMBL.	14643307
Inhibition (binding)	= 22 %	Inhibition of beta-secretase 1 (BACE) was determined at the concentration of 2 uM	ChEMBL.	14643307

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.

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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 403480