Detailed information for compound 429260

Basic information

Technical information
  • TDR Targets ID: 429260
  • Name: 2-[4-[(2S)-2-ethoxy-3-[4-(trifluoromethyl)phe noxy]propyl]sulfanyl-2-methylphenoxy]acetic a cid
  • MW: 444.465 | Formula: C21H23F3O5S
  • H donors: 1 H acceptors: 2 LogP: 5.2 Rotable bonds: 12
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCO[C@@H](COc1ccc(cc1)C(F)(F)F)CSc1ccc(c(c1)C)OCC(=O)O
  • InChi: 1S/C21H23F3O5S/c1-3-27-17(11-28-16-6-4-15(5-7-16)21(22,23)24)13-30-18-8-9-19(14(2)10-18)29-12-20(25)26/h4-10,17H,3,11-13H2,1-2H3,(H,25,26)/t17-/m0/s1
  • InChiKey: JWHYSEDOYMYMNM-KRWDZBQOSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[4-[(2S)-2-ethoxy-3-[4-(trifluoromethyl)phenoxy]propyl]sulfanyl-2-methyl-phenoxy]acetic acid
  • 2-[4-[[(2S)-2-ethoxy-3-[4-(trifluoromethyl)phenoxy]propyl]thio]-2-methylphenoxy]acetic acid
  • 2-[4-[(2S)-2-ethoxy-3-[4-(trifluoromethyl)phenoxy]propyl]sulfanyl-2-methyl-phenoxy]ethanoic acid
  • 2-[4-[[(2S)-2-ethoxy-3-[4-(trifluoromethyl)phenoxy]propyl]thio]-2-methyl-phenoxy]acetic acid

Targets

Known targets for this compound

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

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum IPR008946,Nuclear receptor, ligand-binding,domain-containing Get druggable targets OG5_137778 All targets in OG5_137778
Schistosoma japonicum ko:K08701 nuclear receptor, subfamily 1, invertebrate, putative 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
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 %
Brugia malayi ecdysteroid receptor peroxisome proliferator-activated receptor alpha 468 aa 397 aa 25.4 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi nuclear receptor NHR-88 0.0034 0.0482 0.0491
Plasmodium vivax hypothetical protein, conserved 0.0038 0.0563 1
Toxoplasma gondii transporter, major facilitator family protein 0.0027 0.0352 0.0608
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0018 0.0182 0.0186
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0018 0.0182 0.0178
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.0563 0.0574
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.0563 0.1009
Echinococcus multilocularis expressed protein 0.0018 0.0182 0.0182
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.0563 0.0563
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0016 0.013 0.013
Loa Loa (eye worm) agrin synaptic family protein 0.0018 0.0182 0.0186
Echinococcus multilocularis geminin 0.0514 1 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Loa Loa (eye worm) hypothetical protein 0.0048 0.0773 0.0788
Schistosoma mansoni hypothetical protein 0.0514 1 1
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0046 0.0732 0.0732
Echinococcus granulosus cpg binding protein 0.0032 0.0446 0.0446
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0034 0.0482 0.0491
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0034 0.0482 0.0491
Onchocerca volvulus 0.0027 0.0352 0.0248
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0034 0.0482 0.0491
Brugia malayi Nuclear hormone receptor E75 0.0016 0.013 0.0133
Trichomonas vaginalis CAMK family protein kinase 0.025 0.4761 0.4797
Schistosoma mansoni cpg binding protein 0.0032 0.0446 0.0446
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0064 0.108 0.108
Echinococcus multilocularis SAM and MBT domain containing protein 0.0046 0.0732 0.0732
Trichomonas vaginalis CAMK family protein kinase 0.0504 0.9806 1
Schistosoma mansoni thyroid hormone receptor 0.0034 0.0482 0.0482
Brugia malayi beta-lactamase family protein 0.0038 0.0563 0.0574
Onchocerca volvulus 0.0038 0.0563 0.0466
Mycobacterium tuberculosis Conserved protein 0.0038 0.0563 0.1009
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0706 0.0706
Schistosoma mansoni thyroid hormone receptor 0.0034 0.0482 0.0482
Brugia malayi RNA binding protein 0.0069 0.1185 0.1208
Echinococcus multilocularis follistatin 0.0018 0.0182 0.0182
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0182 0.3425 0.3425
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0034 0.0482 0.0491
Loa Loa (eye worm) MH2 domain-containing protein 0.0136 0.251 0.256
Brugia malayi TAR-binding protein 0.0069 0.1185 0.1208
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0706 0.072
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0053 0.0859 0.0859
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.0563 0.1009
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0053 0.0859 0.0876
Brugia malayi prolyl oligopeptidase family protein 0.0063 0.1068 0.1089
Brugia malayi hypothetical protein 0.0018 0.0168 0.0171
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0034 0.0482 0.0491
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0015 0.0111 0.0111
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0034 0.0482 0.0482
Loa Loa (eye worm) hypothetical protein 0.0018 0.0168 0.0171
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0563 0.0466
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0563 0.0466
Onchocerca volvulus 0.0046 0.0732 0.064
Onchocerca volvulus Putative organic anion transporter 0.0027 0.0352 0.0248
Onchocerca volvulus 0.0027 0.0352 0.0248
Brugia malayi prolyl oligopeptidase family protein 0.0015 0.0111 0.0114
Mycobacterium ulcerans hypothetical protein 0.0038 0.0563 1
Trypanosoma cruzi MFS transporter, putative 0.0027 0.0352 0.0248
Loa Loa (eye worm) MBCTL1 0.0053 0.0859 0.0876
Echinococcus granulosus follistatin 0.0018 0.0182 0.0182
Echinococcus granulosus Nuclear hormone receptor HR96 0.0016 0.013 0.013
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0018 0.0182 0.0186
Brugia malayi tailless protein 0.0016 0.013 0.0133
Loa Loa (eye worm) hypothetical protein 0.0034 0.0482 0.0491
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0241 0.4587 1
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0015 0.0111 0.0111
Echinococcus granulosus FTZ F1 alpha 0.0034 0.0482 0.0482
Loa Loa (eye worm) hypothetical protein 0.0018 0.0182 0.0186
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0018 0.0168 0.0171
Toxoplasma gondii ABC1 family protein 0.0038 0.0563 0.1143
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0563 0.0466
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0034 0.0482 0.0482
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0034 0.0482 0.0491
Loa Loa (eye worm) hypothetical protein 0.0015 0.0111 0.0114
Brugia malayi MH2 domain containing protein 0.0136 0.251 0.256
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0563 0.0466
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0018 0.0182 0.0178
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0034 0.0482 0.0482
Toxoplasma gondii histone lysine methyltransferase SET1 0.0057 0.0945 0.2108
Trichomonas vaginalis esterase, putative 0.0038 0.0563 0.0466
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.0188 0.3539 0.3539
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0504 0.9806 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0069 0.1185 0.1208
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0034 0.0482 0.0491
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0034 0.0482 0.0491
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0706 0.0706
Schistosoma mansoni nuclear hormone receptor 0.0016 0.013 0.013
Brugia malayi prolyl oligopeptidase family protein 0.0015 0.0111 0.0114
Onchocerca volvulus 0.0018 0.0182 0.0073
Echinococcus multilocularis cpg binding protein 0.0032 0.0446 0.0446
Schistosoma mansoni cpg binding protein 0.003 0.0412 0.0412
Schistosoma mansoni retinoic acid receptor RXR 0.0034 0.0482 0.0482
Echinococcus multilocularis nuclear receptor nhr 48 0.0016 0.013 0.013
Echinococcus multilocularis organic anion transporting polypeptide 30B 0.0027 0.0352 0.0352
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0034 0.0482 0.0491
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0001 0.0001
Loa Loa (eye worm) CXXC zinc finger family protein 0.003 0.0412 0.042
Loa Loa (eye worm) hypothetical protein 0.0034 0.0482 0.0491
Schistosoma mansoni serine/threonine protein kinase 0.0504 0.9806 0.9806
Onchocerca volvulus Putative organic anion transporter 0.0027 0.0352 0.0248
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.0063 0.1068 0.0987
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0016 0.013 0.013
Brugia malayi hypothetical protein 0.0016 0.013 0.0133
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Echinococcus multilocularis FTZ F1 alpha 0.0034 0.0482 0.0482
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0018 0.0182 0.0178
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0706 0.0706
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.0563 0.1009
Trypanosoma cruzi polo-like protein kinase, putative 0.0504 0.9806 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Loa Loa (eye worm) hypothetical protein 0.0034 0.0482 0.0491
Loa Loa (eye worm) hypothetical protein 0.0027 0.0352 0.0359
Onchocerca volvulus Serine\/threonine kinase homolog 0.0504 0.9806 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0034 0.0482 0.0491
Mycobacterium leprae Probable lipase LipE 0.0038 0.0563 1
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.0063 0.1068 0.0987
Trichomonas vaginalis CAMK family protein kinase 0.0504 0.9806 1
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.0063 0.1068 0.2419
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.0563 0.1009
Schistosoma mansoni organic anion transporter 0.0027 0.0352 0.0352
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0016 0.013 0.013
Loa Loa (eye worm) hypothetical protein 0.0018 0.0182 0.0186
Loa Loa (eye worm) beta-lactamase 0.0038 0.0563 0.0574
Onchocerca volvulus 0.0027 0.0352 0.0248
Echinococcus granulosus nuclear receptor nhr 48 0.0016 0.013 0.013
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.0563 1
Brugia malayi hypothetical protein 0.0048 0.0773 0.0788
Loa Loa (eye worm) hypothetical protein 0.0018 0.0168 0.0171
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0504 0.9806 0.9806
Echinococcus granulosus acylamino acid releasing enzyme 0.0015 0.0111 0.0111
Loa Loa (eye worm) RNA binding protein 0.0069 0.1185 0.1208
Loa Loa (eye worm) nuclear hormone receptor 0.0016 0.013 0.0133
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0706 0.0706
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0016 0.013 0.0133
Loa Loa (eye worm) hypothetical protein 0.0034 0.0482 0.0491
Trichomonas vaginalis CAMK family protein kinase 0.025 0.4761 0.4797
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0034 0.0482 0.0491
Schistosoma mansoni tar DNA-binding protein 0.0069 0.1185 0.1185
Loa Loa (eye worm) hypothetical protein 0.0034 0.0482 0.0491
Loa Loa (eye worm) hypothetical protein 0.0053 0.0859 0.0876
Loa Loa (eye worm) hypothetical protein 0.0027 0.0352 0.0359
Echinococcus multilocularis polycomb protein SCMH1 0.0046 0.0732 0.0732
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0034 0.0482 0.0491
Echinococcus multilocularis Solute carrier organic anion transporter family 0.0027 0.0352 0.0352
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0034 0.0482 0.0482
Trichomonas vaginalis CAMK family protein kinase 0.0504 0.9806 1
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.0063 0.1068 0.1068
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0016 0.013 0.013
Plasmodium falciparum peptidase, putative 0.0015 0.0111 0.5
Loa Loa (eye worm) hypothetical protein 0.0027 0.0352 0.0359
Loa Loa (eye worm) hypothetical protein 0.0027 0.0352 0.0359
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.0563 0.1009
Loa Loa (eye worm) hypothetical protein 0.0018 0.0168 0.0171
Echinococcus granulosus ecdysone induced protein 78C 0.0034 0.0482 0.0482
Echinococcus granulosus histone acetyltransferase MYST2 0.0053 0.0859 0.0859
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0001 0.0001
Brugia malayi beta-lactamase family protein 0.0038 0.0563 0.0574
Brugia malayi Nuclear hormone receptor-like 1 0.0018 0.0168 0.0171
Loa Loa (eye worm) hypothetical protein 0.0038 0.0563 0.0574
Onchocerca volvulus Putative organic anion transporter 0.0027 0.0352 0.0248
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Brugia malayi conserved hypotetical protein 0.0016 0.013 0.0133
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.0563 0.1009
Loa Loa (eye worm) steroid hormone receptor 0.0034 0.0482 0.0491
Onchocerca volvulus 0.003 0.0412 0.031
Schistosoma mansoni myelin transcription factor 1 myt1 0.0053 0.0859 0.0859
Loa Loa (eye worm) hypothetical protein 0.0027 0.0352 0.0359
Brugia malayi hypothetical protein 0.0018 0.0168 0.0171
Loa Loa (eye worm) mbt repeat family protein 0.0046 0.0732 0.0747
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0034 0.0482 0.0482
Giardia lamblia Kinase, PLK 0.0504 0.9806 1
Trypanosoma cruzi polo-like protein kinase, putative 0.0504 0.9806 1
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0046 0.0732 0.064
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0034 0.0482 0.0491
Brugia malayi sodium-independent organic anion transporter family protein 0.0027 0.0352 0.0359
Schistosoma mansoni tar DNA-binding protein 0.0069 0.1185 0.1185
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0034 0.0482 0.0491
Onchocerca volvulus 0.0038 0.0563 0.0466
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0034 0.0482 0.0482
Schistosoma mansoni tar DNA-binding protein 0.0069 0.1185 0.1185
Brugia malayi photoreceptor-specific nuclear receptor 0.0034 0.0482 0.0491
Echinococcus multilocularis Dipeptidyl peptidase 9 0.0063 0.1068 0.1068
Echinococcus granulosus Nuclear hormone receptor HR96 0.0016 0.013 0.013
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0018 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0027 0.0352 0.0359
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0706 0.0706
Schistosoma mansoni sex comb on midleg homolog 0.0046 0.0732 0.0732
Brugia malayi Nuclear hormone receptor-like 1 0.0018 0.0168 0.0171
Brugia malayi serine/threonine-protein kinase plk-2 0.0504 0.9806 1
Loa Loa (eye worm) prolyl oligopeptidase 0.0188 0.3539 0.3609
Loa Loa (eye worm) hypothetical protein 0.0018 0.0182 0.0186
Brugia malayi prolyl oligopeptidase family protein 0.0188 0.3539 0.3609
Brugia malayi Steroid receptor seven-up type 2 0.0034 0.0482 0.0491
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.0063 0.1068 0.0987
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0563 0.0466
Echinococcus multilocularis thyroid hormone receptor alpha 0.0034 0.0482 0.0482
Trichomonas vaginalis CAMK family protein kinase 0.0504 0.9806 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0034 0.0482 0.0491
Echinococcus granulosus organic anion transporting polypeptide 30B 0.0027 0.0352 0.0352
Echinococcus granulosus agrin 0.0018 0.0182 0.0182
Loa Loa (eye worm) hypothetical protein 0.0038 0.0563 0.0574
Brugia malayi nuclear receptor NHR-67 0.0016 0.013 0.0133
Trypanosoma brucei polo-like protein kinase 0.0504 0.9806 1
Mycobacterium ulcerans beta-lactamase 0.0038 0.0563 1
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.0563 0.0466
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0034 0.0482 0.0382
Loa Loa (eye worm) nuclear receptor NHR-67 0.0016 0.013 0.0133
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0018 0.0182 0.0186
Echinococcus granulosus tar DNA binding protein 0.0069 0.1185 0.1185
Schistosoma mansoni hypothetical protein 0.0281 0.5384 0.5384
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0706 0.0706
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0182 0.3425 0.3425
Trichomonas vaginalis CAMK family protein kinase 0.0504 0.9806 1
Brugia malayi orphan nuclear receptor NR2E1 0.0016 0.013 0.0133
Loa Loa (eye worm) hypothetical protein 0.0038 0.0563 0.0574
Schistosoma mansoni hypothetical protein 0.0514 1 1
Echinococcus granulosus Solute carrier organic anion transporter family 0.0027 0.0352 0.0352
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0034 0.0482 0.0482
Brugia malayi STAT protein, DNA binding domain containing protein 0.0317 0.6103 0.6224
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0018 0.0182 0.0186
Mycobacterium tuberculosis Conserved protein 0.0038 0.0563 0.1009
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0034 0.0482 0.0482
Loa Loa (eye worm) sodium-independent organic anion transporter 0.0027 0.0352 0.0359
Echinococcus granulosus thyroid hormone receptor alpha 0.0016 0.013 0.013
Brugia malayi beta-lactamase 0.0038 0.0563 0.0574
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0034 0.0482 0.0482
Trichomonas vaginalis CAMK family protein kinase 0.0504 0.9806 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0482 0.0491
Brugia malayi nuclear hormone receptor 0.0016 0.013 0.0133
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.0188 0.3539 0.3535
Schistosoma mansoni zinc finger protein 0.0016 0.013 0.013
Schistosoma mansoni agrin 0.0018 0.0182 0.0182
Brugia malayi nuclear hormone receptor 0.0034 0.0482 0.0491
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0034 0.0482 0.0491
Brugia malayi sodium-independent organic anion transporter family protein 0.0027 0.0352 0.0359
Echinococcus granulosus SAM and MBT domain containing protein 0.0046 0.0732 0.0732
Loa Loa (eye worm) kazal-type serine protease inhibitor domain-containing protein 0.0018 0.0182 0.0186
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0563 0.0563
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.0563 0.0574
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0016 0.013 0.0019
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0034 0.0482 0.0482
Brugia malayi mbt repeat family protein 0.0046 0.0732 0.0747
Echinococcus granulosus Dipeptidyl peptidase 9 0.0063 0.1068 0.1068
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0034 0.0482 0.0482
Loa Loa (eye worm) hypothetical protein 0.0034 0.0482 0.0491
Echinococcus multilocularis tar DNA binding protein 0.0069 0.1185 0.1185
Onchocerca volvulus 0.0016 0.013 0.0019
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0706 0.072
Brugia malayi SPARC precursor 0.0018 0.0182 0.0186
Schistosoma mansoni nuclear receptor nhr-48 0.0016 0.013 0.013
Onchocerca volvulus 0.0016 0.013 0.0019
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0706 0.0706
Brugia malayi prolyl oligopeptidase family protein 0.0015 0.0111 0.0114
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0034 0.0482 0.0491
Loa Loa (eye worm) hypothetical protein 0.0038 0.0563 0.0574
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0034 0.0482 0.0482
Onchocerca volvulus 0.0027 0.0352 0.0248
Toxoplasma gondii protease inhibitor PI2 0.0018 0.0182 0.0178
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Loa Loa (eye worm) hypothetical protein 0.0027 0.0352 0.0359
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.0188 0.3539 0.3539
Schistosoma mansoni nuclear receptor 0.0016 0.013 0.013
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.0563 0.0563
Schistosoma mansoni kinase 0.0256 0.4893 0.4893
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0016 0.013 0.013
Schistosoma mansoni steroid hormone receptor ad4bp 0.0034 0.0482 0.0482
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0015 0.0111 0.0111
Schistosoma mansoni nuclear hormone receptor 0.0016 0.013 0.013
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.0063 0.1068 0.0987
Onchocerca volvulus 0.0027 0.0352 0.0248
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0034 0.0482 0.0491
Loa Loa (eye worm) hypothetical protein 0.0018 0.0182 0.0186
Echinococcus multilocularis histone acetyltransferase MYST2 0.0053 0.0859 0.0859
Toxoplasma gondii 1,3-beta-glucan synthase component protein 0.0214 0.4064 1
Echinococcus multilocularis agrin 0.0018 0.0182 0.0182
Loa Loa (eye worm) hypothetical protein 0.0046 0.0732 0.0747
Brugia malayi nuclear hormone receptor family member nhr-6 0.0016 0.013 0.0133
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0034 0.0482 0.0482
Echinococcus multilocularis ecdysone induced protein 78C 0.0034 0.0482 0.0482
Loa Loa (eye worm) hypothetical protein 0.0015 0.0111 0.0114
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0034 0.0482 0.0482
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0016 0.013 0.013
Schistosoma mansoni organic anion transporter 0.0027 0.0352 0.0352
Loa Loa (eye worm) TAR-binding protein 0.0069 0.1185 0.1208
Loa Loa (eye worm) hypothetical protein 0.0034 0.0482 0.0491
Trichomonas vaginalis CAMK family protein kinase 0.0504 0.9806 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0563 0.0466
Brugia malayi nuclear hormone receptor family member odr-7 0.0016 0.013 0.0133
Schistosoma mansoni cpg binding protein 0.0032 0.0446 0.0446
Mycobacterium ulcerans lipase LipD 0.0038 0.0563 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0016 0.013 0.013
Brugia malayi Nuclear hormone receptor-like 1 0.0034 0.0482 0.0491
Schistosoma mansoni nuclear receptor 0.0016 0.013 0.013
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Echinococcus multilocularis acylamino acid releasing enzyme 0.0015 0.0111 0.0111
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0504 0.9806 1
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.0188 0.3539 0.3539
Brugia malayi hypothetical protein 0.0027 0.0352 0.0359
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Brugia malayi sodium-independent organic anion transporter family protein 0.0027 0.0352 0.0359
Echinococcus granulosus prolyl endopeptidase 0.0015 0.0111 0.0111
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0034 0.0482 0.0482
Brugia malayi hypothetical protein 0.0016 0.013 0.0133
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0018 0.0168 0.0168
Schistosoma mansoni coup transcription factor 0.0034 0.0482 0.0482
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0018 0.0168 0.0168
Schistosoma mansoni nuclear hormone receptor 0.0034 0.0482 0.0482
Brugia malayi secreted modular calcium-binding protein 1 0.0018 0.0182 0.0186
Loa Loa (eye worm) hypothetical protein 0.0018 0.0168 0.0171
Schistosoma mansoni tar DNA-binding protein 0.0069 0.1185 0.1185
Brugia malayi nuclear receptor RXR 0.0018 0.0168 0.0171
Brugia malayi Nuclear hormone receptor E75 0.0016 0.013 0.0133
Brugia malayi prostaglandin transporter 0.0027 0.0352 0.0359
Schistosoma mansoni tar DNA-binding protein 0.0069 0.1185 0.1185
Mycobacterium leprae conserved hypothetical protein 0.0038 0.0563 1
Brugia malayi nuclear receptor RXR 0.0016 0.013 0.0133
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.0563 0.1009
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0016 0.013 0.0133
Schistosoma mansoni RAR-like nuclear receptor 0.0034 0.0482 0.0482
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0053 0.0859 0.0859
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.0563 1
Loa Loa (eye worm) hypothetical protein 0.0038 0.0563 0.0574
Brugia malayi CXXC zinc finger family protein 0.003 0.0412 0.042
Brugia malayi mbt repeat family protein 0.0046 0.0732 0.0747
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0563 0.0466
Entamoeba histolytica serine/threonine protein kinase, putative 0.0504 0.9806 1
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0016 0.013 0.013
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0563 0.0563
Brugia malayi nuclear receptor NHR-88 0.0016 0.013 0.0133
Onchocerca volvulus 0.0034 0.0482 0.0382
Loa Loa (eye worm) hypothetical protein 0.0018 0.0168 0.0171
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0034 0.0482 0.0482
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0034 0.0482 0.0482
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0034 0.0482 0.0491
Loa Loa (eye worm) hypothetical protein 0.0038 0.0563 0.0574
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0034 0.0482 0.0491
Brugia malayi ecdysone receptor 0.0016 0.013 0.0133
Onchocerca volvulus Protein ultraspiracle homolog 0.0034 0.0482 0.0382
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0034 0.0482 0.0482
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0018 0.0168 0.0168
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.0063 0.1068 0.0987
Brugia malayi ecdysteroid receptor 0.0034 0.0482 0.0491
Schistosoma mansoni acylaminoacyl-peptidase (S09 family) 0.0015 0.0111 0.0111
Loa Loa (eye worm) DR-78 0.0016 0.013 0.0133
Loa Loa (eye worm) prolyl oligopeptidase 0.0015 0.0111 0.0114
Schistosoma mansoni sex comb on midleg homolog 0.0046 0.0732 0.0732
Brugia malayi steroid hormone receptor 0.0034 0.0482 0.0491
Onchocerca volvulus 0.0038 0.0563 0.0466
Onchocerca volvulus Bile acid receptor homolog 0.0034 0.0482 0.0382
Echinococcus multilocularis prolyl endopeptidase 0.0015 0.0111 0.0111
Schistosoma mansoni follistatin 0.0018 0.0182 0.0182
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0034 0.0482 0.0482
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0432 0.8387 0.8387
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0016 0.013 0.0019
Loa Loa (eye worm) hypothetical protein 0.0016 0.013 0.0133
Loa Loa (eye worm) hypothetical protein 0.0015 0.0111 0.0114
Brugia malayi RNA recognition motif domain containing protein 0.0069 0.1185 0.1208
Mycobacterium tuberculosis Conserved protein 0.0038 0.0563 0.1009
Loa Loa (eye worm) transcription factor SMAD2 0.0136 0.251 0.256
Leishmania major hypothetical protein, conserved 0.0038 0.0563 0.0466
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0018 0.0182 0.0178
Loa Loa (eye worm) STAT protein 0.0317 0.6103 0.6224
Brugia malayi hypothetical protein 0.0027 0.0352 0.0359
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0504 0.9806 0.9806
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0001 0.0001
Echinococcus granulosus polycomb protein SCMH1 0.0046 0.0732 0.0732

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 25 nM Agonist activity at human PPARdelta receptor by cell based transactivation assay ChEMBL. 17524639
EC50 (functional) = 25 nM Agonist activity at human PPARdelta receptor by cell based transactivation assay ChEMBL. 17524639
EC50 (binding) > 1 uM Activity at human PPARgamma receptor by cell based transactivation assay ChEMBL. 17524639
EC50 (binding) > 1 uM Activity at human PPARalpha receptor by cell based transactivation assay ChEMBL. 17524639
EC50 (binding) > 1 uM Activity at human PPARgamma receptor by cell based transactivation assay ChEMBL. 17524639
EC50 (binding) > 1 uM Activity at human PPARalpha receptor by cell based transactivation assay ChEMBL. 17524639
Efficacy (binding) = 93 % Efficacy at human PPARdelta receptor by cell based transactivation assay ChEMBL. 17524639
Efficacy (binding) = 93 % Efficacy at human PPARdelta receptor by cell based transactivation assay ChEMBL. 17524639

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

Bibliographic References

1 literature reference was collected for this gene.

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