Detailed information for compound 992974

Basic information

Technical information
  • TDR Targets ID: 992974
  • Name: 2-[5-[[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-y l)ethoxy]phenyl]methyl]-2-phenyltriazol-4-yl] acetic acid
  • MW: 494.541 | Formula: C29H26N4O4
  • H donors: 1 H acceptors: 5 LogP: 5.8 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)Cc1nn(nc1Cc1cccc(c1)OCCc1nc(oc1C)c1ccccc1)c1ccccc1
  • InChi: 1S/C29H26N4O4/c1-20-25(30-29(37-20)22-10-4-2-5-11-22)15-16-36-24-14-8-9-21(17-24)18-26-27(19-28(34)35)32-33(31-26)23-12-6-3-7-13-23/h2-14,17H,15-16,18-19H2,1H3,(H,34,35)
  • InChiKey: QIGYDDWEDSMCSH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[5-[[3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]methyl]-2-phenyl-triazol-4-yl]acetic acid
  • 2-[5-[[3-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]phenyl]methyl]-2-phenyl-4-triazolyl]acetic acid
  • 2-[5-[3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]benzyl]-2-phenyl-triazol-4-yl]acetic acid
  • 2-[5-[[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]-2-phenyl-1,2,3-triazol-4-yl]ethanoic acid

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
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 mansoni nuclear hormone receptor superfamily protein-related 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 japonicum IPR008946,Nuclear receptor, ligand-binding,domain-containing 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 alpha 468 aa 397 aa 25.4 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Onchocerca volvulus 0.0028 0.0169 0.0249
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0111 0.1226 0.1407
Brugia malayi nuclear hormone receptor 0.0021 0.0078 0.0209
Loa Loa (eye worm) hypothetical protein 0.0021 0.0078 0.0209
Loa Loa (eye worm) hypothetical protein 0.0203 0.2395 0.6426
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0021 0.0078 0.0048
Schistosoma mansoni thyroid hormone receptor 0.0021 0.0078 0.0082
Loa Loa (eye worm) hypothetical protein 0.0064 0.0625 0.1676
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0024 0.0115 0.0309
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0078 0.0209
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0021 0.0078 0.0048
Mycobacterium ulcerans beta-lactamase 0.0111 0.1226 0.5
Echinococcus multilocularis GPCR, family 2 0.0064 0.0625 0.0596
Brugia malayi beta-lactamase 0.0111 0.1226 0.3291
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0062 0.0592 0.0564
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0018 0.0031 0.0196
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0021 0.0078 0.0209
Loa Loa (eye worm) hypothetical protein 0.0028 0.0169 0.0453
Echinococcus granulosus beta LACTamase domain containing family member 0.0111 0.1226 0.12
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0021 0.0078 0.0048
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0021 0.0078 0.0209
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0023 0.0103 0.0073
Schistosoma mansoni steroid hormone receptor ad4bp 0.0021 0.0078 0.0082
Loa Loa (eye worm) hypothetical protein 0.0021 0.0072 0.0193
Brugia malayi Calcitonin receptor-like protein seb-1 0.0203 0.2395 0.6426
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0169 0.0453
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0021 0.0078 0.0048
Echinococcus granulosus zinc finger protein 0.002 0.0063 0.0033
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0115 0.0705
Onchocerca volvulus 0.0111 0.1226 0.3148
Leishmania major phosphatidylinositol 3-kinase, putative 0.0018 0.0031 0.0196
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0078 0.0048
Echinococcus granulosus ecdysone induced protein 78C 0.0021 0.0078 0.0048
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0021 0.0072 0.0531
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0064 0.0625 0.0596
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0021 0.0078 0.0048
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0018 0.0031 0.0196
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0021 0.0078 0.0082
Brugia malayi PHD-finger family protein 0.0026 0.0134 0.0359
Echinococcus multilocularis FTZ F1 alpha 0.0021 0.0078 0.0048
Toxoplasma gondii kinesin motor domain-containing protein 0.0104 0.113 0.919
Loa Loa (eye worm) hypothetical protein 0.0042 0.0342 0.0919
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0169 0.0453
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0203 0.2395 0.6426
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0021 0.0078 0.0048
Echinococcus multilocularis zinc finger protein 0.002 0.0063 0.0033
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0064 0.0625 0.0596
Loa Loa (eye worm) hypothetical protein 0.0021 0.0078 0.0209
Echinococcus granulosus lamin dm0 0.0028 0.0169 0.0139
Loa Loa (eye worm) hypothetical protein 0.0139 0.1576 0.4228
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0169 0.0453
Mycobacterium ulcerans hypothetical protein 0.0111 0.1226 0.5
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0018 0.0031 0.0196
Trichomonas vaginalis penicillin-binding protein, putative 0.0111 0.1226 1
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.0024 0.0115 0.0887
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0078 0.0209
Mycobacterium ulcerans esterase/lipase LipP 0.0111 0.1226 0.5
Leishmania major phosphatidylinositol 3-related kinase, putative 0.0018 0.0031 0.0196
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0021 0.0078 0.0082
Echinococcus granulosus intermediate filament protein 0.0028 0.0169 0.0139
Onchocerca volvulus 0.0111 0.1226 0.3148
Entamoeba histolytica hypothetical protein 0.0024 0.0115 0.0767
Schistosoma mansoni hypothetical protein 0.0139 0.1576 0.1809
Loa Loa (eye worm) PHD-finger family protein 0.0021 0.0077 0.0208
Schistosoma mansoni hypothetical protein 0.0064 0.0625 0.0713
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0078 0.0209
Onchocerca volvulus 0.0111 0.1226 0.3148
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0021 0.0078 0.0048
Echinococcus granulosus GPCR family 2 0.0064 0.0625 0.0596
Echinococcus multilocularis musashi 0.0028 0.0169 0.0139
Loa Loa (eye worm) hypothetical protein 0.0021 0.0078 0.0209
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0078 0.0048
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.003 0.0027
Echinococcus multilocularis ecdysone induced protein 78C 0.0021 0.0078 0.0048
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0021 0.0078 0.0209
Schistosoma mansoni bromodomain containing protein 0.0065 0.064 0.073
Trichomonas vaginalis penicillin-binding protein, putative 0.0111 0.1226 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0021 0.0078 0.0082
Brugia malayi Nuclear hormone receptor-like 1 0.0021 0.0078 0.0209
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0037 0.0279 0.025
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0037 0.0279 0.025
Brugia malayi ecdysteroid receptor 0.0021 0.0078 0.0209
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0078 0.0209
Echinococcus multilocularis lamin 0.0028 0.0169 0.0139
Brugia malayi Latrophilin receptor protein 2 0.0064 0.0625 0.1676
Loa Loa (eye worm) steroid hormone receptor 0.0021 0.0078 0.0209
Loa Loa (eye worm) hypothetical protein 0.0111 0.1226 0.3291
Loa Loa (eye worm) latrophilin receptor protein 2 0.0064 0.0625 0.1676
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0021 0.0078 0.0082
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0018 0.0031 0.0196
Brugia malayi beta-lactamase family protein 0.0111 0.1226 0.3291
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0064 0.0625 0.0596
Trypanosoma cruzi hypothetical protein, conserved 0.0111 0.1226 1
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0018 0.0031 0.0196
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0021 0.0078 0.0209
Schistosoma mansoni lamin 0.0028 0.0169 0.0187
Trichomonas vaginalis D-aminoacylase, putative 0.0111 0.1226 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0021 0.0078 0.0209
Loa Loa (eye worm) phosphatidylinositol 3 0.0018 0.0031 0.0083
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0018 0.0031 0.0001
Schistosoma mansoni hypothetical protein 0.0064 0.0625 0.0713
Echinococcus granulosus FTZ F1 alpha 0.0021 0.0078 0.0048
Leishmania major hypothetical protein, conserved 0.0111 0.1226 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0018 0.003 0.0027
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0021 0.0078 0.0209
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0018 0.0031 0.0028
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0018 0.0031 0.0196
Echinococcus multilocularis lamin dm0 0.0028 0.0169 0.0139
Brugia malayi hypothetical protein 0.0307 0.3727 1
Loa Loa (eye worm) transcription factor SMAD2 0.0123 0.1379 0.3701
Echinococcus granulosus lamin 0.0028 0.0169 0.0139
Leishmania major phosphatidylinositol kinase related protein, putative 0.0018 0.0031 0.02
Trypanosoma brucei hypothetical protein, conserved 0.0111 0.1226 1
Plasmodium falciparum kinesin-5 0.0104 0.113 0.5
Schistosoma mansoni kinesin eg-5 0.0104 0.113 0.1295
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0018 0.0031 0.0196
Schistosoma mansoni cellular tumor antigen P53 0.0103 0.1124 0.1288
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0021 0.0078 0.0209
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0021 0.0078 0.0209
Loa Loa (eye worm) hypothetical protein 0.0021 0.0078 0.0209
Schistosoma mansoni hypothetical protein 0.0021 0.0077 0.0081
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0427 0.5253 0.6052
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0078 0.0048
Loa Loa (eye worm) hypothetical protein 0.0021 0.0078 0.0209
Mycobacterium leprae conserved hypothetical protein 0.0111 0.1226 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0021 0.0078 0.0209
Toxoplasma gondii ABC1 family protein 0.0111 0.1226 1
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0018 0.0031 0.0001
Loa Loa (eye worm) hypothetical protein 0.0111 0.1226 0.3291
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0018 0.0031 0.0001
Loa Loa (eye worm) hypothetical protein 0.0111 0.1226 0.3291
Loa Loa (eye worm) hypothetical protein 0.0103 0.1124 0.3016
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0021 0.0078 0.0209
Echinococcus multilocularis kinesin family 1 0.0799 1 1
Brugia malayi Kinesin motor domain containing protein 0.0104 0.113 0.3031
Trichomonas vaginalis D-aminoacylase, putative 0.0111 0.1226 1
Brugia malayi nuclear receptor NHR-88 0.0021 0.0078 0.0209
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0018 0.003 0.0027
Brugia malayi Steroid receptor seven-up type 2 0.0021 0.0078 0.0209
Brugia malayi MH2 domain containing protein 0.0123 0.1379 0.3701
Echinococcus multilocularis beta LACTamase domain containing family member 0.0111 0.1226 0.12
Mycobacterium ulcerans lipase LipD 0.0111 0.1226 0.5
Brugia malayi Bromodomain containing protein 0.0077 0.0794 0.2131
Onchocerca volvulus 0.0103 0.1124 0.2866
Loa Loa (eye worm) bromodomain containing protein 0.0018 0.0038 0.0103
Schistosoma mansoni hypothetical protein 0.0064 0.0625 0.0713
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0021 0.0078 0.0209
Schistosoma mansoni zinc finger protein 0.002 0.0063 0.0065
Onchocerca volvulus 0.0028 0.0169 0.0249
Trichomonas vaginalis esterase, putative 0.0111 0.1226 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0064 0.0625 0.0596
Echinococcus granulosus serine protein kinase ATM 0.0024 0.0115 0.0085
Loa Loa (eye worm) hypothetical protein 0.0021 0.0078 0.0209
Plasmodium vivax hypothetical protein, conserved 0.0111 0.1226 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0018 0.0031 0.0083
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0018 0.0031 0.0001
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0024 0.0115 0.0125
Trichomonas vaginalis D-aminoacylase, putative 0.0111 0.1226 1
Echinococcus granulosus fetal alzheimer antigen falz 0.0023 0.0103 0.0073
Brugia malayi intermediate filament protein 0.0028 0.0169 0.0453
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0018 0.0031 0.0196
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.003 0.0027
Loa Loa (eye worm) hypothetical protein 0.0021 0.0078 0.0209
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0103 0.011
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0021 0.0078 0.0082
Schistosoma mansoni hypothetical protein 0.0064 0.0625 0.0713
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0018 0.0031 0.0028
Loa Loa (eye worm) hypothetical protein 0.0073 0.0738 0.1979
Loa Loa (eye worm) hypothetical protein 0.0018 0.003 0.0081
Brugia malayi latrophilin 2 splice variant baaae 0.0139 0.1576 0.4228
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0078 0.0209
Loa Loa (eye worm) hypothetical protein 0.0307 0.3727 1
Schistosoma mansoni intermediate filament proteins 0.0028 0.0169 0.0187
Toxoplasma gondii FATC domain-containing protein 0.0024 0.0115 0.0705
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0078 0.0048
Echinococcus multilocularis serine protein kinase ATM 0.0024 0.0115 0.0085
Schistosoma mansoni nuclear hormone receptor 0.0021 0.0078 0.0082
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0018 0.0031 0.0196
Echinococcus granulosus tumor protein p63 0.0706 0.8814 0.881
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0018 0.0031 0.0196
Giardia lamblia Kinesin-5 0.0104 0.113 1
Brugia malayi photoreceptor-specific nuclear receptor 0.0021 0.0078 0.0209
Onchocerca volvulus 0.0307 0.3727 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0711 0.8885 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0111 0.1226 0.1407
Echinococcus multilocularis tumor protein p63 0.0706 0.8814 0.881
Loa Loa (eye worm) beta-lactamase 0.0111 0.1226 0.3291
Brugia malayi beta-lactamase family protein 0.0111 0.1226 0.3291
Loa Loa (eye worm) hypothetical protein 0.004 0.0311 0.0835
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0078 0.0209
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0111 0.1226 0.3291
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0062 0.0592 0.0564
Loa Loa (eye worm) kinesin-like protein KLP2 0.0104 0.113 0.3031
Schistosoma mansoni RAR-like nuclear receptor 0.0021 0.0078 0.0082
Schistosoma mansoni lamin 0.0028 0.0169 0.0187
Entamoeba histolytica kinesin, putative 0.0104 0.113 1
Schistosoma mansoni coup transcription factor 0.0021 0.0078 0.0082
Loa Loa (eye worm) hypothetical protein 0.0044 0.0368 0.0986
Schistosoma mansoni hypothetical protein 0.0695 0.8676 1
Loa Loa (eye worm) hypothetical protein 0.0111 0.1226 0.3291
Loa Loa (eye worm) hypothetical protein 0.0111 0.1226 0.3291
Loa Loa (eye worm) MH2 domain-containing protein 0.0123 0.1379 0.3701
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0021 0.0078 0.0209
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0111 0.1226 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0203 0.2395 0.6426
Loa Loa (eye worm) hypothetical protein 0.0021 0.0078 0.0209
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0018 0.0031 0.02
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0064 0.0625 0.1676
Trypanosoma cruzi hypothetical protein, conserved 0.0111 0.1226 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0021 0.0078 0.0048
Brugia malayi Bromodomain containing protein 0.004 0.031 0.0832
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0021 0.0078 0.0082
Mycobacterium leprae Probable lipase LipE 0.0111 0.1226 0.5
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0021 0.0078 0.0048
Loa Loa (eye worm) phosphatidylinositol 3 0.0018 0.0031 0.0083
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0021 0.0078 0.0209
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0024 0.0115 0.0887
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0021 0.0078 0.0048
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0018 0.0031 0.0196
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0018 0.0031 0.0196
Trypanosoma cruzi target of rapamycin kinase 3 0.0018 0.0031 0.0196
Schistosoma mansoni thyroid hormone receptor 0.0021 0.0078 0.0082
Loa Loa (eye worm) hypothetical protein 0.0028 0.0162 0.0435
Schistosoma mansoni retinoic acid receptor RXR 0.0021 0.0078 0.0082
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0111 0.1226 0.3291
Loa Loa (eye worm) hypothetical protein 0.0111 0.1226 0.3291
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0018 0.0031 0.0083
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0021 0.0078 0.0209
Brugia malayi steroid hormone receptor 0.0021 0.0078 0.0209

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 36 % Antidiabetic activity in db/db mouse assessed as reduction in plasma glucose level at 10 mg/kg, po administered once daily for 14 days ChEMBL. 19201606
Activity (functional) = 50 % Antidyslipidemic activity in db/db mouse assessed as reduction in plasma triglyceride level at 10 mg/kg, po administered once daily for 14 days ChEMBL. 19201606
EC50 (binding) = 0.004 uM Agonist activity at human PPARgamma ligand binding domain expressed in HEK293 cells by Gal4 transactivation assay ChEMBL. 19201606
EC50 (binding) = 0.006 uM Agonist activity at human PPARalpha ligand binding domain expressed in HEK293 cells by Gal4 transactivation assay ChEMBL. 19201606
IC50 (binding) = 0.005 uM Binding affinity to PPARgamma by fluorescence polarization assay ChEMBL. 19201606
IC50 (binding) = 0.085 uM Binding affinity to PPARalpha by fluorescence polarization assay ChEMBL. 19201606
Intrinsic activity (binding) = 83 % Intrinsic activity at human PPARalpha ligand binding domain expressed in HEK293 cells at 1 uM by Gal4 transactivation assay relative to GW-2331 ChEMBL. 19201606
Intrinsic activity (binding) = 138 % Intrinsic activity at human PPARgamma ligand binding domain expressed in HEK293 cells at 1 uM by Gal4 transactivation assay relative to rosiglitazone ChEMBL. 19201606

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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