TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 326.429 | Formula: C21H26O3
H donors: 0 H acceptors: 0 LogP: 4.97 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: C=C(c1ccccc1)C1CCOC2(OO1)C1CC3CC2CC(C1)C3
InChi: 1S/C21H26O3/c1-14(17-5-3-2-4-6-17)20-7-8-22-21(24-23-20)18-10-15-9-16(12-18)13-19(21)11-15/h2-6,15-16,18-20H,1,7-13H2
InChiKey: ULFRQVQRUYXXSY-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
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0026	0.0294	0.0294
Brugia malayi	photoreceptor-specific nuclear receptor	0.0056	0.1185	0.1185
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0026	0.0294	0.0294
Trypanosoma cruzi	cysteine peptidase, putative	0.0063	0.141	1
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0158	0.4303	0.4303
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0226	1
Loa Loa (eye worm)	nuclear hormone receptor	0.0026	0.0294	0.0294
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0056	0.1185	0.1185
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0056	0.1185	0.1185
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0056	0.1185	0.1185
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0226	1
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0026	0.0294	0.0294
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0056	0.1185	0.1185
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0056	0.1185	0.1185
Schistosoma mansoni	protein tyrosine phosphatase non-receptor type nt1	0.0346	1	1
Schistosoma mansoni	coup transcription factor	0.0056	0.1185	0.1185
Loa Loa (eye worm)	steroid hormone receptor	0.0056	0.1185	0.1185
Schistosoma mansoni	nuclear receptor nhr-48	0.0026	0.0294	0.0294
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0226	0.5
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0187	0.5167	0.5167
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0226	0.1601
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0026	0.0294	0.0294
Brugia malayi	hypothetical protein	0.0026	0.0294	0.0294
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0024	0.0226	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0063	0.141	1
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0056	0.1185	0.1185
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0226	0.1601
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0056	0.1185	0.1185
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.141	0.5
Brugia malayi	Nuclear hormone receptor E75	0.0026	0.0294	0.0294
Leishmania major	cathepsin L-like protease	0.0063	0.141	1
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0029	0.0389	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0389	0.0389
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0056	0.1185	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0024	0.0226	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0017	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Echinococcus granulosus	muscleblind protein	0.0148	0.3974	0.3974
Echinococcus multilocularis	FTZ F1 alpha	0.0056	0.1185	0.1185
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Brugia malayi	Nuclear hormone receptor-like 1	0.0029	0.0389	0.0389
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0056	0.1185	0.1185
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0056	0.1185	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0056	0.1185	0.1185
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0056	0.1185	0.1185
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.141	0.5
Brugia malayi	hypothetical protein	0.0029	0.0389	0.0389
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0056	0.1185	0.1185
Brugia malayi	tailless protein	0.0026	0.0294	0.0294
Loa Loa (eye worm)	hypothetical protein	0.0056	0.1185	0.1185
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0056	0.1185	0.1185
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.141	0.5
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0226	0.1601
Loa Loa (eye worm)	hypothetical protein	0.0056	0.1185	0.1185
Brugia malayi	nuclear receptor RXR	0.0026	0.0294	0.0294
Brugia malayi	Steroid receptor seven-up type 2	0.0056	0.1185	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0056	0.1185	0.1185
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0056	0.1185	0.1185
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0026	0.0294	0.0294
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0389	0.0389
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0056	0.1185	0.1185
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0026	0.0294	0.0294
Loa Loa (eye worm)	hypothetical protein	0.005	0.1016	0.1016
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0226	0.5
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0029	0.0389	0.0389
Leishmania major	cathepsin L-like protease	0.0063	0.141	1
Schistosoma mansoni	nuclear receptor	0.0026	0.0294	0.0294
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0056	0.1185	0.1185
Brugia malayi	nuclear hormone receptor	0.0056	0.1185	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0042	0.0042
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Toxoplasma gondii	cathepsin CPL	0.0017	0	0.5
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0	0.5
Echinococcus granulosus	tumor protein p63	0.0342	0.9867	0.9867
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0018	0.0042	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0	0.5
Schistosoma mansoni	nuclear hormone receptor	0.0026	0.0294	0.0294
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0056	0.1185	0.1185
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.141	0.5
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0056	0.1185	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0042	0.0042
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0389	0.0389
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0026	0.0294	0.0294
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.141	0.5
Schistosoma mansoni	nuclear hormone receptor	0.0056	0.1185	0.1185
Schistosoma mansoni	thyroid hormone receptor	0.0187	0.5167	0.5167
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0056	0.1185	0.1185
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0058	0.1244	0.8824
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.141	0.5
Loa Loa (eye worm)	hypothetical protein	0.0056	0.1185	0.1185
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0056	0.1185	0.1185
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.0131	0.348	0.348
Brugia malayi	ecdysteroid receptor	0.0056	0.1185	0.1185
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0	0.5
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0026	0.0294	0.2481
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0056	0.1185	0.1185
Brugia malayi	nuclear receptor NHR-67	0.0026	0.0294	0.0294
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0056	0.1185	0.1185
Brugia malayi	conserved hypotetical protein	0.0026	0.0294	0.0294
Onchocerca volvulus		0.0056	0.1185	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0226	1
Loa Loa (eye worm)	hypothetical protein	0.0148	0.3974	0.3974
Brugia malayi	Nuclear hormone receptor-like 1	0.0029	0.0389	0.0389
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0026	0.0294	0.0294
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.141	0.5
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0026	0.0294	0.0294
Leishmania major	cathepsin L-like protease	0.0063	0.141	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0056	0.1185	0.1185
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0029	0.0389	0.0389
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0056	0.1185	0.1185
Echinococcus granulosus	ecdysone induced protein 78C	0.0056	0.1185	0.1185
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0056	0.1185	0.1185
Onchocerca volvulus		0.0026	0.0294	0.2481
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0226	0.0226
Schistosoma mansoni	zinc finger protein	0.0026	0.0294	0.0294
Schistosoma mansoni	retinoic acid receptor RXR	0.0158	0.4303	0.4303
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0042	0.0042
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0	0.5
Echinococcus granulosus	FTZ F1 alpha	0.0056	0.1185	0.1185
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0024	0.0226	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0042	0.0042
Echinococcus multilocularis	muscleblind protein 1	0.0148	0.3974	0.3974
Onchocerca volvulus	Protein ultraspiracle homolog	0.0056	0.1185	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0056	0.1185	0.1185
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0026	0.0294	0.0294
Brugia malayi	hypothetical protein	0.0026	0.0294	0.0294
Schistosoma mansoni	hypothetical protein	0.0131	0.348	0.348
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Onchocerca volvulus		0.0024	0.0226	0.1905
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0056	0.1185	0.1185
Trypanosoma cruzi	major cysteine proteinase, putative	0.005	0.1001	0.7098
Brugia malayi	steroid hormone receptor	0.0056	0.1185	0.1185
Brugia malayi	hypothetical protein	0.0029	0.0389	0.0389
Brugia malayi	ecdysone receptor	0.0026	0.0294	0.0294
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0226	0.0226
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.141	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0056	0.1185	0.1185
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0	0.5
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0026	0.0294	0.0294
Schistosoma mansoni	nuclear receptor	0.0026	0.0294	0.0294
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0056	0.1185	0.1185
Echinococcus granulosus	nuclear receptor nhr 48	0.0026	0.0294	0.0294
Onchocerca volvulus	Bile acid receptor homolog	0.0056	0.1185	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.141	0.5
Brugia malayi	Nuclear hormone receptor E75	0.0026	0.0294	0.0294
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0226	0.0226
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0	0.5
Echinococcus multilocularis	tumor protein p63	0.0342	0.9867	0.9867
Schistosoma mansoni	nuclear hormone receptor	0.0026	0.0294	0.0294
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0389	0.0389
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0	0.5
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0026	0.0294	0.0294
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0226	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Echinococcus multilocularis	muscleblind protein	0.0148	0.3974	0.3974
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0056	0.1185	0.1185
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0056	0.1185	0.1185
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0029	0.0389	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0056	0.1185	0.1185
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0389	0.0389
Brugia malayi	Muscleblind-like protein	0.0148	0.3974	0.3974
Schistosoma mansoni	thyroid hormone receptor	0.0187	0.5167	0.5167
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0056	0.1185	0.1185
Trypanosoma cruzi	cruzipain precursor, putative	0.0063	0.141	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0056	0.1185	0.1185
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0026	0.0294	0.0294
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0056	0.1185	0.1185
Mycobacterium ulcerans	hypothetical protein	0.0024	0.0226	1
Onchocerca volvulus		0.0026	0.0294	0.2481
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0056	0.1185	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0024	0.0226	1
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0226	0.0226
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.0131	0.348	0.348
Schistosoma mansoni	cellular tumor antigen P53	0.005	0.1016	0.1016
Brugia malayi	nuclear receptor RXR	0.0029	0.0389	0.0389
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0	0.5
Echinococcus multilocularis	ecdysone induced protein 78C	0.0056	0.1185	0.1185
Brugia malayi	nuclear hormone receptor family member odr-7	0.0026	0.0294	0.0294
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0346	1	1
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0026	0.0294	0.0294
Loa Loa (eye worm)	DR-78	0.0026	0.0294	0.0294
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0	0.5
Entamoeba histolytica	acyl-coA synthetase, putative	0.0024	0.0226	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0056	0.1185	0.1185
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0346	1	1
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0029	0.0389	0.0389
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0056	0.1185	0.1185
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0346	1	1
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0056	0.1185	0.1185
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0024	0.0226	1
Brugia malayi	nuclear receptor NHR-88	0.0056	0.1185	0.1185
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0056	0.1185	0.1185
Trypanosoma cruzi	cysteine peptidase, putative	0.0063	0.141	1
Brugia malayi	nuclear receptor NHR-88	0.0026	0.0294	0.0294
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0056	0.1185	0.1185
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0056	0.1185	0.1185
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0026	0.0294	0.2481
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0018	0.0042	0.139
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0042	0.0042
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0129	0.3412	0.3412
Echinococcus multilocularis	nuclear receptor nhr 48	0.0026	0.0294	0.0294
Echinococcus granulosus	thyroid hormone receptor alpha	0.0026	0.0294	0.0294
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0017	0	0.5
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0056	0.1185	1
Brugia malayi	nuclear hormone receptor	0.0026	0.0294	0.0294
Schistosoma mansoni	RAR-like nuclear receptor	0.0056	0.1185	0.1185
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Brugia malayi	orphan nuclear receptor NR2E1	0.0026	0.0294	0.0294
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Plasmodium falciparum	acyl-CoA synthetase	0.0018	0.0042	1
Plasmodium vivax	acyl-CoA synthetase, putative	0.0018	0.0042	1
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0226	0.0226
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0226	1
Onchocerca volvulus		0.005	0.1016	0.8571
Loa Loa (eye worm)	hypothetical protein	0.0148	0.3974	0.3974
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0226	0.0226
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0056	0.1185	0.1185
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0294	0.0294
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0024	0.0226	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.141	0.5
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.141	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	= 27.41 %	Antimarial activity against multidrug resistant Plasmodium yoelii in Swiss mouse assessed as suppression of parasitaemia at 96 mg/kg, im after 4 days	ChEMBL.	18054238
Activity (functional)	= 27.41 %	Antimarial activity against multidrug resistant Plasmodium yoelii in Swiss mouse assessed as suppression of parasitaemia at 96 mg/kg, im after 4 days	ChEMBL.	18054238
Activity (functional)	= 57.36 %	Antimarial activity against multidrug resistant Plasmodium yoelii in Swiss mouse assessed as suppression of parasitaemia at 96 mg/kg, po after 4 days	ChEMBL.	18054238
Activity (functional)	= 57.36 %	Antimarial activity against multidrug resistant Plasmodium yoelii in Swiss mouse assessed as suppression of parasitaemia at 96 mg/kg, po after 4 days	ChEMBL.	18054238

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL437234

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 516319