TDR Targets

Basic information

Technical information

TDR Targets ID: 256772
Name: 2-[4-[3-[4-(2-hydroxyethyl)-1-[(4-methylpheny l)methyl]-5-oxo-1,2,4-triazol-3-yl]propyl]phe noxy]-2-methylpropanoic acid
MW: 453.531 | Formula: C25H31N3O5
H donors: 2 H acceptors: 4 LogP: 3.14 Rotable bonds: 11
Rule of 5 violations (Lipinski): 1
SMILES: OCCn1c(CCCc2ccc(cc2)OC(C(=O)O)(C)C)nn(c1=O)Cc1ccc(cc1)C
InChi: 1S/C25H31N3O5/c1-18-7-9-20(10-8-18)17-28-24(32)27(15-16-29)22(26-28)6-4-5-19-11-13-21(14-12-19)33-25(2,3)23(30)31/h7-14,29H,4-6,15-17H2,1-3H3,(H,30,31)
InChiKey: YUKWDLIKAHBTHE-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

2-[4-[3-[4-(2-hydroxyethyl)-5-oxo-1-(p-tolylmethyl)-1,2,4-triazol-3-yl]propyl]phenoxy]-2-methyl-propanoic acid
2-[4-[3-[4-(2-hydroxyethyl)-5-oxo-1-(p-tolylmethyl)-1,2,4-triazol-3-yl]propyl]phenoxy]-2-methylpropanoic acid
2-[4-[3-[4-(2-hydroxyethyl)-1-[(4-methylphenyl)methyl]-5-oxo-1,2,4-triazol-3-yl]propyl]phenoxy]-2-methyl-propanoic acid
2-[4-[3-[4-(2-hydroxyethyl)-5-keto-1-(4-methylbenzyl)-1,2,4-triazol-3-yl]propyl]phenoxy]-2-methyl-propionic acid

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	peroxisome proliferator-activated receptor delta	Starlite/ChEMBL	References
Homo sapiens	peroxisome proliferator-activated receptor alpha	Starlite/ChEMBL	References
Homo sapiens	peroxisome proliferator-activated receptor gamma	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K08701 nuclear receptor, subfamily 1, invertebrate, putative	Get druggable targets OG5_137778	All targets in OG5_137778
Schistosoma japonicum	IPR008946,Nuclear receptor, ligand-binding,domain-containing	Get druggable targets OG5_137778	All targets in OG5_137778
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	Get druggable targets OG5_137778	All targets in OG5_137778

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	ecdysteroid receptor	peroxisome proliferator-activated receptor alpha	468 aa	397 aa	25.4 %
Echinococcus granulosus	ecdysone induced protein 78C	peroxisome proliferator-activated receptor gamma	477 aa	447 aa	28.2 %
Brugia malayi	ecdysteroid receptor	peroxisome proliferator-activated receptor delta	441 aa	369 aa	24.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	photoreceptor-specific nuclear receptor	0.0034	0.0174	0.0331
Loa Loa (eye worm)	hypothetical protein	0.0746	0.5251	1
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0034	0.0174	0.0174
Loa Loa (eye worm)	DOMON domain-containing protein	0.0143	0.0953	0.1815
Echinococcus multilocularis	ecdysone induced protein 78C	0.0034	0.0174	0.0331
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0034	0.0174	0.0332
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0016	0.0048	0.0038
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0034	0.0174	0.0331
Schistosoma mansoni	thyroid hormone receptor	0.0034	0.0174	0.0174
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0031	0.0156	0.0297
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0015	0.0042	0.008
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0034	0.0174	0.0331
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0016	0.0048	0.0091
Brugia malayi	nuclear hormone receptor	0.0034	0.0174	0.0331
Echinococcus granulosus	ecdysone induced protein 78C	0.0034	0.0174	0.0331
Brugia malayi	Copper type II ascorbate-dependent monooxygenase, C-terminal domain containing protein	0.0746	0.5251	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0034	0.0174	0.0174
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Echinococcus granulosus	netrin receptor unc 5	0.0015	0.0042	0.0079
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0216	0.1477	0.2812
Entamoeba histolytica	recQ family helicase, putative	0.0012	0.002	0.5
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0156	0.0298
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0432	0.3016	0.3016
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.0009	0	0.0001
Brugia malayi	Bloom's syndrome protein homolog	0.0022	0.0093	0.0177
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0028	0.0135	0.0257
Echinococcus multilocularis	nuclear receptor nhr 48	0.0016	0.0048	0.0091
Schistosoma mansoni	intermediate filament proteins	0.0028	0.0135	0.0135
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Loa Loa (eye worm)	steroid hormone receptor	0.0034	0.0174	0.0332
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0016	0.0048	0.0091
Echinococcus multilocularis	peptidyl glycine alpha amidating monooxygenase	0.0746	0.5251	1
Loa Loa (eye worm)	nuclear hormone receptor	0.0016	0.0048	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0746	0.5251	1
Echinococcus granulosus	peptidyl glycine alpha amidating monooxygenase	0.0746	0.5251	1
Schistosoma mansoni	hypothetical protein	0.0015	0.0042	0.0041
Brugia malayi	Nuclear hormone receptor E75	0.0016	0.0048	0.0091
Echinococcus granulosus	intermediate filament protein	0.0028	0.0135	0.0256
Brugia malayi	Nuclear hormone receptor E75	0.0016	0.0048	0.0091
Echinococcus multilocularis	musashi	0.0028	0.0135	0.0256
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0016	0.0048	0.0048
Loa Loa (eye worm)	cytochrome P450 family protein	0.0016	0.0052	0.01
Schistosoma mansoni	nuclear receptor	0.0016	0.0048	0.0048
Loa Loa (eye worm)	cytochrome P450 family protein	0.0016	0.0052	0.01
Echinococcus granulosus	death domain containing protein	0.0015	0.0042	0.0079
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0009	0	0.0000000019064
Brugia malayi	Nuclear hormone receptor-like 1	0.0034	0.0174	0.0331
Onchocerca volvulus		0.0016	0.0048	0.0038
Onchocerca volvulus		0.0143	0.0953	0.5526
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0034	0.0174	0.0331
Brugia malayi	hypothetical protein	0.0016	0.0048	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0014	0.0032	0.0059
Loa Loa (eye worm)	DOMON domain-containing protein	0.0143	0.0953	0.1815
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0016	0.0052	0.5
Brugia malayi	Copper type II ascorbate-dependent monooxygenase, N-terminal domain containing protein	0.0379	0.2633	0.5013
Brugia malayi	Protein kinase domain containing protein	0.0015	0.0042	0.0079
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0174	0.0332
Schistosoma mansoni	blooms syndrome DNA helicase	0.0018	0.006	0.006
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Onchocerca volvulus	Bile acid receptor homolog	0.0034	0.0174	0.0804
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0174	0.0332
Trichomonas vaginalis	DNA helicase recq1, putative	0.0022	0.0093	0.0441
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0016	0.0048	0.0091
Brugia malayi	Steroid receptor seven-up type 2	0.0034	0.0174	0.0331
Onchocerca volvulus		0.0143	0.0953	0.5526
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Brugia malayi	DOMON domain containing protein	0.0143	0.0953	0.1814
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0174	0.0332
Brugia malayi	hypothetical protein	0.0018	0.0061	0.0116
Loa Loa (eye worm)	DOMON domain-containing protein	0.0143	0.0953	0.1815
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0174	0.0332
Echinococcus granulosus	ankyrin repeat and death domain containing protein	0.0015	0.0042	0.0079
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0034	0.0174	0.0331
Brugia malayi	Cytochrome P450 family protein	0.0016	0.0052	0.0099
Brugia malayi	Copper type II ascorbate-dependent monooxygenase, C-terminal domain containing protein	0.0746	0.5251	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0034	0.0174	0.0332
Brugia malayi	nuclear receptor NHR-88	0.0016	0.0048	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0174	0.0332
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0015	0.0041	0.2589
Brugia malayi	DOMON domain containing protein	0.0143	0.0953	0.1814
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0018	0.0061	0.0116
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0034	0.0174	0.0331
Brugia malayi	DOMON domain containing protein	0.0143	0.0953	0.1814
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0034	0.0174	0.0331
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0034	0.0174	0.0331
Brugia malayi	Death domain containing protein	0.0015	0.0042	0.0079
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0034	0.0174	0.0174
Schistosoma mansoni	coup transcription factor	0.0034	0.0174	0.0174
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0034	0.0174	0.0331
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0034	0.0174	0.0331
Schistosoma mansoni	lamin	0.0028	0.0135	0.0135
Brugia malayi	nuclear receptor NHR-67	0.0016	0.0048	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0061	0.0117
Brugia malayi	orphan nuclear receptor NR2E1	0.0016	0.0048	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0028	0.0053
Brugia malayi	Uncoordinated protein 44	0.0015	0.0042	0.0079
Schistosoma mansoni	peptidyl-glycine monooxygenase	0.0746	0.5251	0.5251
Echinococcus granulosus	bloom syndrome protein	0.0022	0.0093	0.0177
Loa Loa (eye worm)	intermediate filament protein	0.0028	0.0135	0.0257
Schistosoma mansoni	nuclear hormone receptor	0.0034	0.0174	0.0174
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0135	0.0257
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0031	0.0156	0.0156
Schistosoma mansoni	zinc finger protein	0.0016	0.0048	0.0048
Brugia malayi	cytoplasmic intermediate filament protein	0.0015	0.0042	0.008
Trichomonas vaginalis	DNA helicase recq, putative	0.0022	0.0093	0.0441
Brugia malayi	Intermediate filament tail domain containing protein	0.0028	0.0135	0.0256
Brugia malayi	tailless protein	0.0016	0.0048	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0042	0.0081
Schistosoma mansoni	ankyrin 23/unc44	0.0015	0.0042	0.0041
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0034	0.0174	0.0331
Echinococcus multilocularis	FTZ F1 alpha	0.0034	0.0174	0.0331
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0015	0.0042	0.0079
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0034	0.0174	0.0331
Schistosoma mansoni	nuclear receptor	0.0016	0.0048	0.0048
Brugia malayi	nuclear receptor RXR	0.0016	0.0048	0.0091
Brugia malayi	steroid hormone receptor	0.0034	0.0174	0.0331
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0034	0.0174	0.0331
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0034	0.0174	0.0331
Onchocerca volvulus		0.0016	0.0048	0.0038
Onchocerca volvulus		0.0028	0.0135	0.0566
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0034	0.0174	0.0331
Echinococcus multilocularis	netrin receptor unc 5	0.0015	0.0042	0.0079
Schistosoma mansoni	netrin receptor unc5	0.0015	0.0042	0.0041
Echinococcus granulosus	lamin dm0	0.0028	0.0135	0.0256
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0034	0.0174	0.0331
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0031	0.0156	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0018	0.0061	0.0116
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0016	0.0048	0.0091
Loa Loa (eye worm)	CYP4Cod1	0.0016	0.0052	0.01
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0061	0.0116
Loa Loa (eye worm)	RecQ helicase	0.0022	0.0093	0.0177
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0034	0.0174	0.0331
Schistosoma mansoni	thyroid hormone receptor	0.0034	0.0174	0.0174
Trypanosoma cruzi	cytochrome P450, putative	0.0016	0.0052	1
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0016	0.0048	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0174	0.0332
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0016	0.0048	0.0091
Brugia malayi	nuclear hormone receptor family member odr-7	0.0016	0.0048	0.0091
Schistosoma mansoni	RAR-like nuclear receptor	0.0034	0.0174	0.0174
Echinococcus granulosus	thyroid hormone receptor alpha	0.0016	0.0048	0.0091
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0031	0.0156	0.0156
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0034	0.0174	0.0332
Echinococcus granulosus	lamin	0.0028	0.0135	0.0256
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0241	0.1651	0.3144
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.0019	0.0074	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0034	0.0174	0.0331
Trypanosoma cruzi	cytochrome P450, putative	0.0016	0.0052	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0034	0.0174	0.0332
Brugia malayi	hypothetical protein	0.0018	0.0061	0.0116
Echinococcus multilocularis	ankyrin repeat and death domain containing protein	0.0015	0.0042	0.0079
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0034	0.0174	0.0331
Schistosoma mansoni	retinoic acid receptor RXR	0.0034	0.0174	0.0174
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0034	0.0174	0.0332
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Brugia malayi	Nuclear hormone receptor-like 1	0.0018	0.0061	0.0116
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0031	0.0156	0.0297
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0034	0.0174	0.0174
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0018	0.0061	0.0116
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0032	0.006
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0042	0.0079
Schistosoma mansoni	nuclear receptor nhr-48	0.0016	0.0048	0.0048
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0034	0.0174	0.0804
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0174	0.0332
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0016	0.0048	0.0091
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0015	0.0042	0.0079
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0061	0.0117
Echinococcus multilocularis	Ankyrin	0.0015	0.0042	0.008
Onchocerca volvulus		0.0031	0.0156	0.0695
Schistosoma mansoni	nuclear hormone receptor	0.0016	0.0048	0.0048
Schistosoma mansoni	peptidylglycine monooxygenase	0.0746	0.5251	0.5251
Brugia malayi	Pre-SET motif family protein	0.0216	0.1477	0.2812
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Echinococcus granulosus	Ankyrin	0.0015	0.0042	0.008
Echinococcus granulosus	histone lysine methyltransferase setb	0.0031	0.0156	0.0297
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0174	0.0332
Brugia malayi	Cytochrome P450 family protein	0.0016	0.0052	0.0099
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0061	0.0117
Plasmodium vivax	SET domain protein, putative	0.0031	0.0156	1
Onchocerca volvulus	Protein ultraspiracle homolog	0.0034	0.0174	0.0804
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0061	0.0117
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0034	0.0174	0.0174
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0034	0.0174	0.0331
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0016	0.0048	0.0091
Loa Loa (eye worm)	DR-78	0.0016	0.0048	0.0091
Echinococcus multilocularis	nuclear factor of activated T cells 5	0.0077	0.0481	0.0915
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0034	0.0174	0.0331
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0061	0.0117
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0034	0.0174	0.0331
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0034	0.0174	0.0331
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Echinococcus multilocularis	lamin dm0	0.0028	0.0135	0.0256
Brugia malayi	Pre-SET motif family protein	0.0031	0.0156	0.0297
Brugia malayi	nuclear receptor RXR	0.0018	0.0061	0.0116
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0034	0.0174	0.0174
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0018	0.0061	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0028	0.0053
Brugia malayi	hypothetical protein	0.0016	0.0048	0.0091
Onchocerca volvulus		0.0028	0.0135	0.0566
Brugia malayi	Copper type II ascorbate-dependent monooxygenase, C-terminal domain containing protein	0.0368	0.2553	0.4862
Echinococcus multilocularis	bloom syndrome protein	0.0022	0.0093	0.0177
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0031	0.0156	0.0156
Brugia malayi	nuclear hormone receptor	0.0016	0.0048	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0048	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0131	0.025
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0034	0.0174	0.0331
Echinococcus granulosus	FTZ F1 alpha	0.0034	0.0174	0.0331
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0016	0.0048	0.0091
Onchocerca volvulus		0.0246	0.1691	1
Brugia malayi	intermediate filament protein	0.0028	0.0135	0.0256
Trypanosoma brucei	cytochrome P450, putative	0.0016	0.0052	1
Schistosoma mansoni	retinoblastoma-binding protein 4 (rbbp4)	0.0015	0.0042	0.0042
Brugia malayi	conserved hypotetical protein	0.0016	0.0048	0.0091
Onchocerca volvulus		0.0034	0.0174	0.0804
Echinococcus multilocularis	lamin	0.0028	0.0135	0.0256
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0034	0.0174	0.0174
Giardia lamblia	Sgs1 DNA helicase, putative	0.0009	0	0.5
Brugia malayi	nuclear receptor NHR-88	0.0034	0.0174	0.0331
Trichomonas vaginalis	set domain proteins, putative	0.0246	0.169	1
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0034	0.0174	0.0331
Leishmania major	cytochrome p450-like protein	0.0016	0.0052	1
Schistosoma mansoni	nuclear hormone receptor	0.0016	0.0048	0.0048
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0034	0.0174	0.0331
Schistosoma mansoni	lamin	0.0028	0.0135	0.0135
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0034	0.0174	0.0331
Brugia malayi	follicle stimulating hormone receptor	0.0241	0.1651	0.3143
Brugia malayi	ecdysteroid receptor	0.0034	0.0174	0.0331
Echinococcus granulosus	nuclear factor of activated T cells 5	0.0077	0.0481	0.0915
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0016	0.0048	0.0091
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.003	0.0148	0.0281
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0034	0.0174	0.0332
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0034	0.0174	0.0332
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0016	0.0048	0.0091
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0016	0.0048	0.0038
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0016	0.0048	0.0091
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0018	0.0061	0.0061
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0034	0.0174	0.0331
Loa Loa (eye worm)	hypothetical protein	0.0009	0	0.0001
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0014	0.0032	0.0059
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0016	0.0048	0.0091
Echinococcus granulosus	nuclear receptor nhr 48	0.0016	0.0048	0.0091
Brugia malayi	ecdysone receptor	0.0016	0.0048	0.0091
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0031	0.0156	0.0156
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0018	0.0061	0.0061

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	= 88 nM	Cotransfection activity against human Peroxisome proliferator activated receptor alpha	ChEMBL.	14613314
EC50 (functional)	= 88 nM	Cotransfection activity against human Peroxisome proliferator activated receptor alpha	ChEMBL.	14613314
Efficacy (functional)	= 20 %	Cotransfection activity of compound against human Peroxisome proliferator activated receptor gamma was determined at 10 microM	ChEMBL.	14613314
Efficacy (functional)	= 20 %	Cotransfection activity of compound against human Peroxisome proliferator activated receptor delta was determined at 10 microM	ChEMBL.	14613314
Efficacy (functional)	= 20 %	Cotransfection activity of compound against human Peroxisome proliferator activated receptor gamma was determined at 10 microM	ChEMBL.	14613314
Efficacy (functional)	= 20 %	Cotransfection activity of compound against human Peroxisome proliferator activated receptor delta was determined at 10 microM	ChEMBL.	14613314
IC50 (functional)	= 5.215	Agonist activity at PPARgamma	ChEMBL.	22564380
IC50 (functional)	= 5.387	Agonist activity at PPARdelta	ChEMBL.	22564380
IC50 (functional)	= 7.569	Agonist activity at PPARalpha	ChEMBL.	22564380
IC50 (binding)	= 27 nM	Inhibitory activity against human Peroxisome proliferator activated receptor alpha	ChEMBL.	14613314
IC50 (binding)	= 27 nM	Inhibitory activity against human Peroxisome proliferator activated receptor alpha	ChEMBL.	14613314
IC50 (binding)	= 4100 nM	Inhibitory activity of compound against the binding of human Peroxisome proliferator activated receptor delta was determined	ChEMBL.	14613314
IC50 (binding)	= 4100 nM	Inhibitory activity of compound against the binding of human Peroxisome proliferator activated receptor delta was determined	ChEMBL.	14613314
IC50 (binding)	= 6100 nM	Inhibitory activity of compound against the binding of human Peroxisome proliferator activated receptor gamma was determined	ChEMBL.	14613314
IC50 (binding)	= 6100 nM	Inhibitory activity of compound against the binding of human Peroxisome proliferator activated receptor gamma was determined	ChEMBL.	14613314

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: CHEMBL148774
PubChem: 11339975

Bibliographic References

2 literature references were collected for this gene.

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Detailed information for compound 256772