TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 940 | Formula: C46H61N5O16
H donors: 8 H acceptors: 12 LogP: -0.84 Rotable bonds: 4
Rule of 5 violations (Lipinski): 4
SMILES: O=C1CNC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)N[C@H]([C@H](C(=O)O[C@H]2C[C@]3([C@@H](O1)C1[C@@]4(COC4C[C@@H]([C@@]1(C)C(=O)[C@@H](C(=C2C)C3(C)C)O)O)OC(=O)C)O)O)c1ccccc1)C(C)C
InChi: 1S/C46H61N5O16/c1-21(2)32-40(60)51-15-11-14-25(51)39(59)48-18-29(54)47-19-30(55)66-38-36-44(7,27(53)16-28-45(36,20-64-28)67-23(4)52)37(58)34(56)31-22(3)26(17-46(38,63)43(31,5)6)65-41(61)35(57)33(50-42(62)49-32)24-12-9-8-10-13-24/h8-10,12-13,21,25-28,32-36,38,53,56-57,63H,11,14-20H2,1-7H3,(H,47,54)(H,48,59)(H2,49,50,62)/t25-,26-,27-,28?,32-,33-,34+,35+,36?,38-,44+,45-,46+/m0/s1
InChiKey: WAIBDWCPSFKODJ-CSBPLPSKSA-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
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0049	0.2284	0.2803
Mycobacterium ulcerans	methyltransferase	0.0152	0.8767	1
Brugia malayi	Cathepsin L-like precursor	0.0019	0.0366	0.0366
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0049	0.2284	1
Schistosoma mansoni	serine/threonine kinase	0.0055	0.2655	0.326
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.0055	0.2655	0.326
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0072	0.3714	0.3714
Trypanosoma cruzi	cysteine peptidase, putative	0.0072	0.3714	0.4559
Brugia malayi	Papain family cysteine protease containing protein	0.0019	0.0366	0.0366
Trichomonas vaginalis	AGC family protein kinase	0.0171	1	1
Toxoplasma gondii	AGC kinase	0.0161	0.9332	1
Mycobacterium ulcerans	mycolic acid synthase UmaA	0.0152	0.8767	1
Brugia malayi	Cathepsin L-like precursor	0.0019	0.0366	0.0366
Loa Loa (eye worm)	glutathione reductase	0.0142	0.8146	0.8146
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.0049	0.2284	0.2605
Schistosoma mansoni	serine/threonine-protein kinase	0.0117	0.6594	0.8095
Brugia malayi	Protein kinase domain containing protein	0.0055	0.2655	0.2655
Echinococcus multilocularis	nervana 2	0.0106	0.5851	0.7183
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0117	0.6594	0.8095
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.014	0.8018	0.9842
Echinococcus granulosus	serine/threonine protein kinase	0.0117	0.6594	0.8095
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.0161	0.9332	0.9332
Echinococcus granulosus	protein kinase C gamma type	0.0055	0.2655	0.326
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.0049	0.2284	0.2447
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Trichomonas vaginalis	AGC family protein kinase	0.0055	0.2655	0.2655
Onchocerca volvulus		0.003	0.1094	1
Brugia malayi	alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase	0.0036	0.1458	0.1458
Plasmodium falciparum	phosphoethanolamine N-methyltransferase	0.0161	0.9347	1
Entamoeba histolytica	cysteine proteinase, putative	0.0019	0.0366	0.0366
Trypanosoma brucei	carnitine O-palmitoyltransferase II, putative	0.0026	0.0797	0.0797
Giardia lamblia	Kinase, AGC PKA	0.0107	0.5926	1
Trypanosoma cruzi	carnitine O-acetyltransferase, putative	0.0026	0.0797	0.0978
Echinococcus granulosus	nervana 2	0.0106	0.5851	0.7183
Echinococcus multilocularis	cysteine protease	0.0019	0.0366	0.0449
Echinococcus multilocularis	serine threonine protein kinase	0.0055	0.2655	0.326
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.0049	0.2284	0.2803
Trypanosoma cruzi	hypothetical protein, conserved	0.0026	0.0797	0.0978
Onchocerca volvulus		0.0019	0.0366	0.3348
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein	0.0036	0.1458	0.1458
Onchocerca volvulus		0.0026	0.0797	0.7285
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0049	0.2284	0.2803
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.0049	0.2284	1
Entamoeba histolytica	cysteine proteinase, putative	0.0019	0.0366	0.0366
Brugia malayi	Cathepsin L-like precursor	0.0019	0.0366	0.0366
Loa Loa (eye worm)	hypothetical protein	0.003	0.1094	0.1094
Echinococcus multilocularis	Glutaredoxin protein 5	0.0106	0.5851	0.7183
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0019	0.0366	0.0366
Trypanosoma cruzi	Protein kinase B	0.0117	0.6594	0.8095
Brugia malayi	Intermediate filament tail domain containing protein	0.003	0.1094	0.1094
Trypanosoma cruzi	trypanothione reductase, putative	0.0049	0.2284	0.2803
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0049	0.2284	0.2284
Trypanosoma cruzi	cruzipain precursor, putative	0.0072	0.3714	0.4559
Trypanosoma brucei	trypanothione reductase	0.0142	0.8146	0.8146
Trichomonas vaginalis	AGC family protein kinase	0.0171	1	1
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.0049	0.2284	0.2284
Leishmania major	cathepsin L-like protease	0.0019	0.0366	0.0449
Leishmania major	cysteine peptidase A (CPA)	0.0019	0.0366	0.0449
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0016	0.0203	0.0203
Echinococcus multilocularis	protein kinase c epsilon type	0.0055	0.2655	0.326
Loa Loa (eye worm)	fibroinase	0.0019	0.0366	0.0366
Echinococcus multilocularis	nervana 2	0.0106	0.5851	0.7183
Schistosoma mansoni	lamin	0.003	0.1094	0.1342
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0019	0.0366	0.0366
Echinococcus granulosus	cathepsin l1	0.0019	0.0366	0.0449
Leishmania major	cathepsin L-like protease	0.0019	0.0366	0.0449
Plasmodium vivax	vivapain-2	0.0019	0.0366	0.0392
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0049	0.2284	0.2803
Plasmodium falciparum	glutathione reductase	0.0049	0.2284	0.2443
Loa Loa (eye worm)	choline O-acetyltransferase	0.0026	0.0797	0.0797
Loa Loa (eye worm)	choline/Carnitine O-acyltransferase	0.0026	0.0797	0.0797
Loa Loa (eye worm)	carnitine O-palmitoyltransferase I isoform	0.0026	0.0797	0.0797
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	0.0106	0.5851	0.7183
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	0.0106	0.5851	0.7183
Schistosoma mansoni	serine/threonine protein kinase	0.0055	0.2655	0.326
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0019	0.0366	0.0449
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.0055	0.2655	0.2655
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0072	0.3714	0.3714
Plasmodium falciparum	thioredoxin reductase	0.0142	0.8146	0.8715
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Loa Loa (eye worm)	intermediate filament protein	0.003	0.1094	0.1094
Schistosoma mansoni	lamin	0.003	0.1094	0.1342
Plasmodium vivax	dihydrolipoyl dehydrogenase, apicoplast, putative	0.0049	0.2284	0.2443
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.0049	0.2284	0.2803
Schistosoma mansoni	cathepsin F (C01 family)	0.0019	0.0366	0.0449
Loa Loa (eye worm)	AGC/PKN protein kinase	0.0055	0.2655	0.2655
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.0107	0.5926	0.7275
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0019	0.0366	0.0366
Trypanosoma cruzi	hypothetical protein, conserved	0.0026	0.0797	0.0978
Entamoeba histolytica	protein kinase 2, putative	0.0107	0.5926	0.5926
Loa Loa (eye worm)	cysteine protease	0.0019	0.0366	0.0366
Plasmodium vivax	thioredoxin reductase, putative	0.0142	0.8146	0.8715
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0049	0.2284	0.2605
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0055	0.2655	0.326
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0049	0.2284	0.2803
Mycobacterium tuberculosis	Possible mycolic acid synthase UmaA	0.0152	0.8767	1
Schistosoma mansoni	serine/threonine protein kinase	0.0055	0.2655	0.326
Schistosoma mansoni	choline o-acyltransferase	0.0026	0.0797	0.0978
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.0107	0.5926	0.7275
Schistosoma mansoni	serine/threonine protein kinase	0.0055	0.2655	0.326
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0019	0.0366	0.0449
Onchocerca volvulus		0.0019	0.0366	0.3348
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0015	0.0101	0.0124
Onchocerca volvulus		0.0019	0.0366	0.3348
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.003	0.1094	0.1094
Mycobacterium tuberculosis	Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot	0.0049	0.2284	0.2605
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0117	0.6594	0.6594
Onchocerca volvulus		0.003	0.1094	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.0049	0.2284	0.2605
Trypanosoma cruzi	carnitine/choline acetyltransferase, putative	0.0026	0.0797	0.0978
Trichomonas vaginalis	serine/threonine-protein kinase sgk, putative	0.0054	0.258	0.258
Onchocerca volvulus		0.0019	0.0366	0.3348
Schistosoma mansoni	cathepsin F (C01 family)	0.0019	0.0366	0.0449
Brugia malayi	Protein kinase domain containing protein	0.0055	0.2655	0.2655
Echinococcus granulosus	serine:threonine protein kinase N2	0.0055	0.2655	0.326
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0101	0.0101
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0072	0.3714	0.3714
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0072	0.3714	0.3714
Brugia malayi	p70 ribosomal S6 kinase beta	0.0161	0.9332	0.9332
Leishmania major	carnitine palmitoyltransferase-like protein	0.0026	0.0797	0.0978
Echinococcus granulosus	serine threonine protein kinase nrc	0.0107	0.5926	0.7275
Leishmania major	cathepsin L-like protease	0.0072	0.3714	0.4559
Trichomonas vaginalis	AGC family protein kinase	0.0055	0.2655	0.2655
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0019	0.0366	0.0366
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0019	0.0366	0.0366
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Plasmodium falciparum	thioredoxin reductase	0.0049	0.2284	0.2443
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0366	0.0366
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0019	0.0366	0.0392
Echinococcus multilocularis	serine:threonine protein kinase 38	0.0055	0.2655	0.326
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0019	0.0366	0.0366
Trichomonas vaginalis	AGC family protein kinase	0.0171	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0072	0.3714	0.3714
Echinococcus multilocularis	carnitine O palmitoyltransferase 1, liver	0.014	0.8018	0.9842
Plasmodium falciparum	dihydrolipoyl dehydrogenase, apicoplast	0.0049	0.2284	0.2443
Brugia malayi	Thioredoxin reductase	0.0142	0.8146	0.8146
Echinococcus granulosus	choline O acetyltransferase	0.0026	0.0797	0.0978
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.0055	0.2655	0.2655
Toxoplasma gondii	NADPH-glutathione reductase	0.0049	0.2284	0.2447
Brugia malayi	intermediate filament protein	0.003	0.1094	0.1094
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Loa Loa (eye worm)	thioredoxin reductase	0.0142	0.8146	0.8146
Echinococcus granulosus	Protein kinase C brain isozyme	0.0055	0.2655	0.326
Trichomonas vaginalis	AGC family protein kinase	0.0171	1	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0019	0.0366	0.0392
Echinococcus granulosus	carnitine O palmitoyltransferase 2	0.0026	0.0797	0.0978
Echinococcus multilocularis	cathepsin L cysteine protease	0.0019	0.0366	0.0449
Echinococcus granulosus	lamin dm0	0.003	0.1094	0.1342
Trypanosoma cruzi	carnitine O-palmitoyltransferase II, putative	0.0026	0.0797	0.0978
Entamoeba histolytica	cysteine protease, putative	0.0019	0.0366	0.0366
Schistosoma mansoni	intermediate filament proteins	0.003	0.1094	0.1342
Schistosoma mansoni	choline o-acyltransferase	0.0026	0.0797	0.0978
Trypanosoma brucei	hypothetical protein, conserved	0.0026	0.0797	0.0797
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0049	0.2284	0.2803
Trichomonas vaginalis	AGC family protein kinase	0.0066	0.3324	0.3324
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0019	0.0366	0.0366
Brugia malayi	glutathione reductase	0.0142	0.8146	0.8146
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0072	0.3714	0.3714
Leishmania major	trypanothione reductase	0.0142	0.8146	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0072	0.3714	0.3714
Echinococcus granulosus	lamin	0.003	0.1094	0.1342
Plasmodium falciparum	dihydrolipoyl dehydrogenase, mitochondrial	0.0049	0.2284	0.2443
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0072	0.3714	0.3714
Onchocerca volvulus		0.0026	0.0797	0.7285
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0049	0.2284	0.2803
Giardia lamblia	NADH oxidase lateral transfer candidate	0.0049	0.2284	0.3854
Trypanosoma brucei	carnitine O-palmitoyltransferase II, putative	0.0026	0.0797	0.0797
Leishmania major	cathepsin L-like protease	0.0019	0.0366	0.0449
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.0026	0.0797	0.0978
Entamoeba histolytica	protein kinase, putative	0.0171	1	1
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0055	0.2655	0.326
Trypanosoma cruzi	carnitine/choline acetyltransferase, putative	0.0026	0.0797	0.0978
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0171	1	1
Echinococcus granulosus	thioredoxin glutathione reductase	0.0142	0.8146	1
Onchocerca volvulus	Cathepsin F homolog	0.0019	0.0366	0.3348
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.0055	0.2655	0.2655
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0019	0.0366	0.0366
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Echinococcus granulosus	protein kinase c epsilon type	0.0055	0.2655	0.326
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.0055	0.2655	0.326
Schistosoma mansoni	serine/threonine protein kinase	0.0055	0.2655	0.326
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0019	0.0366	0.0449
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0015	0.0101	0.0124
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0019	0.0366	0.0366
Brugia malayi	Cathepsin L-like precursor	0.0019	0.0366	0.0366
Trypanosoma cruzi	cysteine peptidase, putative	0.0019	0.0366	0.0449
Onchocerca volvulus		0.0019	0.0366	0.3348
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0049	0.2284	0.2803
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Plasmodium vivax	glutathione reductase, putative	0.0142	0.8146	0.8715
Leishmania major	cathepsin L-like protease	0.0019	0.0366	0.0449
Plasmodium falciparum	RAC-beta serine/threonine protein kinase	0.0107	0.5926	0.634
Trichomonas vaginalis	AGC family protein kinase	0.0171	1	1
Schistosoma mansoni	serine/threonine protein kinase	0.0055	0.2655	0.326
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0049	0.2284	0.2605
Echinococcus multilocularis	lamin dm0	0.003	0.1094	0.1342
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.0055	0.2655	0.326
Trypanosoma brucei	rac serine-threonine kinase, putative	0.0171	1	1
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0142	0.8146	0.9292
Leishmania major	choline/Carnitine o-acyltransferase-like protein	0.014	0.8018	0.9842
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0049	0.2284	0.2803
Schistosoma mansoni	serine/threonine-protein kinase	0.0117	0.6594	0.8095
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0049	0.2284	1
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.0049	0.2284	0.2605
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0072	0.3714	0.3714
Plasmodium vivax	phosphoethanolamine N-methyltransferase	0.0161	0.9347	1
Schistosoma mansoni	serine/threonine protein kinase	0.0055	0.2655	0.326
Plasmodium vivax	rac-beta serine/threonine protein kinase, putative	0.0107	0.5926	0.634
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.0026	0.0797	0.0797
Onchocerca volvulus		0.0019	0.0366	0.3348
Brugia malayi	cytoplasmic intermediate filament protein	0.0016	0.0203	0.0203
Loa Loa (eye worm)	hypothetical protein	0.014	0.8018	0.8018
Leishmania major	cathepsin L-like protease	0.0019	0.0366	0.0449
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0049	0.2284	0.2284
Trypanosoma cruzi	hypothetical protein, conserved	0.0026	0.0797	0.0978
Brugia malayi	Choline O-acetyltransferase	0.0026	0.0797	0.0797
Toxoplasma gondii	thioredoxin reductase	0.0142	0.8146	0.873
Echinococcus multilocularis	cathepsin L cysteine protease	0.0019	0.0366	0.0449
Trichomonas vaginalis	AGC family protein kinase	0.0171	1	1
Echinococcus granulosus	nervana 2	0.0106	0.5851	0.7183
Echinococcus granulosus	NDR protein kinase	0.0055	0.2655	0.326
Trypanosoma brucei	carnitine O-palmitoyltransferase, putative	0.0026	0.0797	0.0797
Onchocerca volvulus		0.0026	0.0797	0.7285
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0117	0.6594	0.6594
Brugia malayi	Hr1 repeat family protein	0.0055	0.2655	0.2655
Toxoplasma gondii	cathepsin CPL	0.0019	0.0366	0.0392
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0049	0.2284	0.2284
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.014	0.8018	0.8018
Plasmodium vivax	vivapain-2	0.0019	0.0366	0.0392
Leishmania major	carnitine/choline acetyltransferase, putative	0.0026	0.0797	0.0978
Onchocerca volvulus	Cathepsin L homolog	0.0019	0.0366	0.3348
Echinococcus multilocularis	carnitine O palmitoyltransferase 2	0.0026	0.0797	0.0978
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.0055	0.2655	0.326
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0049	0.2284	1
Trichomonas vaginalis	glutathione reductase, putative	0.0049	0.2284	0.2284
Mycobacterium tuberculosis	Possible methyltransferase (methylase)	0.0152	0.8767	1
Entamoeba histolytica	protein kinase, putative	0.0171	1	1
Plasmodium vivax	dihydrolipoyl dehydrogenase, mitochondrial, putative	0.0049	0.2284	0.2443
Treponema pallidum	NADH oxidase	0.0049	0.2284	1
Entamoeba histolytica	protein kinase, putative	0.0055	0.2655	0.2655
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.014	0.8018	0.9842
Onchocerca volvulus		0.0026	0.0797	0.7285
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.0055	0.2655	0.326
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0019	0.0366	0.0366
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.0049	0.2284	0.2803
Trypanosoma brucei	carnitine O-acetyltransferase, putative	0.0026	0.0797	0.0797
Trypanosoma cruzi	hypothetical protein, conserved	0.0026	0.0797	0.0978
Trichomonas vaginalis	AGC family protein kinase	0.0171	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Trichomonas vaginalis	mercuric reductase, putative	0.0049	0.2284	0.2284
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0055	0.2655	0.326
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0072	0.3714	0.3714
Trypanosoma cruzi	trypanothione reductase, putative	0.0142	0.8146	1
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0049	0.2284	0.2803
Echinococcus granulosus	carnitine O palmitoyltransferase 1 liver	0.014	0.8018	0.9842
Trypanosoma cruzi	cysteine peptidase, putative	0.0072	0.3714	0.4559
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0049	0.2284	0.2803
Brugia malayi	protein kinase C II.	0.0055	0.2655	0.2655
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0019	0.0366	0.0366
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0142	0.8146	1
Trichomonas vaginalis	AGC family protein kinase	0.0055	0.2655	0.2655
Loa Loa (eye worm)	hypothetical protein	0.003	0.1058	0.1058
Echinococcus granulosus	Glutaredoxin protein 5	0.0106	0.5851	0.7183
Brugia malayi	Choline O-acetyltransferase	0.0026	0.0797	0.0797
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0107	0.5926	0.7275
Schistosoma mansoni	atypical protein kinase C	0.0055	0.2655	0.326
Trypanosoma cruzi	cysteine peptidase, putative	0.0072	0.3714	0.4559
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0072	0.3714	0.3714
Trypanosoma cruzi	hypothetical protein, conserved	0.0026	0.0797	0.0978
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.0055	0.2655	0.326
Schistosoma mansoni	serine/threonine protein kinase	0.0055	0.2655	0.326
Echinococcus multilocularis	cysteine protease	0.0019	0.0366	0.0449
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0066	0.0066
Trypanosoma cruzi	choline/carnitine O-acetyltransferase, putative	0.0026	0.0797	0.0978
Echinococcus granulosus	intermediate filament protein	0.003	0.1094	0.1342
Echinococcus multilocularis	rac serine:threonine kinase	0.0117	0.6594	0.8095
Onchocerca volvulus		0.0019	0.0366	0.3348
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0019	0.0366	0.0366
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0049	0.2284	0.2803
Echinococcus multilocularis	choline O acetyltransferase	0.0026	0.0797	0.0978
Echinococcus multilocularis	protein kinase c iota type	0.0055	0.2655	0.326
Loa Loa (eye worm)	ctsf protein	0.0019	0.0366	0.0366
Entamoeba histolytica	protein kinase, putative	0.0161	0.9332	0.9332
Plasmodium falciparum	glutathione reductase	0.0142	0.8146	0.8715
Brugia malayi	Cathepsin L-like precursor	0.0019	0.0366	0.0366
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.0026	0.0797	0.0797
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0066	0.332	0.4075
Onchocerca volvulus	Cathepsin L homolog	0.0019	0.0366	0.3348
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0055	0.2655	0.2655
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0019	0.0366	0.0366
Trypanosoma cruzi	major cysteine proteinase, putative	0.0056	0.2742	0.3366
Loa Loa (eye worm)	AGC/NDR protein kinase	0.0055	0.2655	0.2655
Echinococcus granulosus	protein kinase c iota type	0.0055	0.2655	0.326
Leishmania major	cathepsin L-like protease	0.0072	0.3714	0.4559
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0797	0.0797
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0066	0.0066
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0019	0.0366	0.0392
Echinococcus multilocularis	lamin	0.003	0.1094	0.1342
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0019	0.0366	0.0366
Mycobacterium tuberculosis	Probable oxidoreductase	0.0049	0.2284	0.2605
Brugia malayi	Cathepsin L-like precursor	0.0019	0.0366	0.0366
Echinococcus multilocularis	musashi	0.003	0.1094	0.1342
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0049	0.2284	0.2803
Leishmania major	cathepsin L-like protease	0.0072	0.3714	0.4559
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.0049	0.2284	0.2284
Loa Loa (eye worm)	hypothetical protein	0.0055	0.2655	0.2655
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0019	0.0366	0.0449

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (ADMET)	0	Cytotoxicity against human KB cells after 72 hrs	ChEMBL.	17064914

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 421880