Detailed information for compound 1114338

Basic information

Technical information
  • TDR Targets ID: 1114338
  • Name: 2-[[4-[(7-hydroxy-2,3-dihydro-1H-inden-4-yl)o xy]-3,5-dimethylphenyl]amino]-2-oxoacetic aci d
  • MW: 341.358 | Formula: C19H19NO5
  • H donors: 3 H acceptors: 4 LogP: 3.8 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)C(=O)Nc1cc(C)c(c(c1)C)Oc1ccc(c2c1CCC2)O
  • InChi: 1S/C19H19NO5/c1-10-8-12(20-18(22)19(23)24)9-11(2)17(10)25-16-7-6-15(21)13-4-3-5-14(13)16/h6-9,21H,3-5H2,1-2H3,(H,20,22)(H,23,24)
  • InChiKey: CEYPDXWCYTVSDN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[[4-(7-hydroxyindan-4-yl)oxy-3,5-dimethyl-phenyl]amino]-2-oxo-acetic acid
  • 2-[[4-[(7-hydroxy-4-indanyl)oxy]-3,5-dimethylphenyl]amino]-2-oxoacetic acid
  • 2-[[4-(7-hydroxyindan-4-yl)oxy-3,5-dimethyl-phenyl]amino]-2-keto-acetic acid
  • 2-[[4-[(7-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-3,5-dimethyl-phenyl]amino]-2-oxo-ethanoic acid

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens thyroid hormone receptor, alpha Starlite/ChEMBL References
Homo sapiens thyroid hormone receptor, beta Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum ko:K08362 nuclear receptor, subfamily 1, group A, member 2, putative Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma mansoni hypothetical protein Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma japonicum expressed protein Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma mansoni thyroid hormone receptor Get druggable targets OG5_134830 All targets in OG5_134830
Brugia malayi Nuclear hormone receptor-like 1 Get druggable targets OG5_156853 All targets in OG5_156853
Schistosoma mansoni thyroid hormone receptor Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma japonicum Thyroid hormone receptor alpha, putative Get druggable targets OG5_134830 All targets in OG5_134830
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal Get druggable targets OG5_134830 All targets in OG5_134830
Echinococcus multilocularis thyroid hormone receptor alpha Get druggable targets OG5_134830 All targets in OG5_134830
Brugia malayi Nuclear hormone receptor-like 1 Get druggable targets OG5_156853 All targets in OG5_156853
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma japonicum Thyroid hormone receptor alpha, putative Get druggable targets OG5_134830 All targets in OG5_134830
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_156853 All targets in OG5_156853
Loa Loa (eye worm) nuclear hormone receptor-like 1 Get druggable targets OG5_156853 All targets in OG5_156853
Brugia malayi Nuclear hormone receptor-like 1 Get druggable targets OG5_156853 All targets in OG5_156853
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi photoreceptor-specific nuclear receptor thyroid hormone receptor, beta 461 aa 414 aa 24.6 %
Brugia malayi photoreceptor-specific nuclear receptor thyroid hormone receptor, alpha 451 aa 372 aa 25.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0231 0.3458 0.7325
Toxoplasma gondii aldehyde dehydrogenase 0.01 0.1247 1
Onchocerca volvulus 0.0085 0.0987 0.495
Echinococcus multilocularis lysosomal alpha glucosidase 0.0146 0.2026 0.2026
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.01 0.1247 0.1247
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0064 0.0263
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0035 0.0144 0.0075
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0265 0.4031 0.3989
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0097 0.1194 0.1194
Echinococcus granulosus intermediate filament protein 0.0054 0.0469 0.0469
Schistosoma mansoni nuclear hormone receptor 0.0035 0.0144 0.0075
Loa Loa (eye worm) jmjC domain-containing protein 0.0097 0.1194 0.2529
Brugia malayi jmjC domain containing protein 0.0097 0.1194 0.238
Loa Loa (eye worm) hypothetical protein 0.0124 0.1643 0.348
Brugia malayi RNA recognition motif domain containing protein 0.0231 0.3458 0.6918
Brugia malayi jmjC domain containing protein 0.0097 0.1194 0.238
Loa Loa (eye worm) steroid hormone receptor 0.0035 0.0144 0.0305
Onchocerca volvulus 0.0054 0.0469 0.191
Schistosoma mansoni retinoic acid receptor RXR 0.0035 0.0144 0.0075
Trichomonas vaginalis sucrase-isomaltase, putative 0.0032 0.0109 0.5
Echinococcus multilocularis isocitrate dehydrogenase 0.003 0.007 0.007
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0032 0.0109 0.5
Toxoplasma gondii isocitrate dehydrogenase 0.003 0.007 0.0248
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0142 0.1958 1
Brugia malayi Nuclear hormone receptor-like 1 0.0306 0.4721 0.945
Loa Loa (eye worm) latrophilin receptor protein 2 0.0057 0.0525 0.1113
Trypanosoma brucei glucosidase, putative 0.0032 0.0109 0.3914
Loa Loa (eye worm) hypothetical protein 0.0057 0.0525 0.1113
Schistosoma mansoni thyroid hormone receptor 0.0187 0.2705 0.2654
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0089 0.1065 0.1002
Loa Loa (eye worm) hypothetical protein 0.0035 0.0144 0.0305
Trichomonas vaginalis maltase-glucoamylase, putative 0.0032 0.0109 0.5
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0035 0.0144 0.0275
Loa Loa (eye worm) hypothetical protein 0.0054 0.0469 0.0994
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0064 0.0198
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0035 0.0144 0.0305
Echinococcus granulosus lamin 0.0054 0.0469 0.0469
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0035 0.0144 0.0275
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0265 0.4031 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0032 0.0109 0.5
Schistosoma mansoni hypothetical protein 0.0057 0.0525 0.0459
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.003 0.007 0.0329
Schistosoma mansoni microtubule-associated protein tau 0.062 1 1
Loa Loa (eye worm) intermediate filament protein 0.0054 0.0469 0.0994
Trichomonas vaginalis alpha-glucosidase, putative 0.0032 0.0109 0.5
Loa Loa (eye worm) hypothetical protein 0.0136 0.1848 0.3914
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.003 0.007 0.052
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0035 0.0144 0.0275
Schistosoma mansoni hypothetical protein 0.0124 0.1643 0.1584
Schistosoma mansoni jumonji domain containing protein 0.0097 0.1194 0.1132
Brugia malayi intermediate filament protein 0.0054 0.0469 0.0928
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0082 0.0948 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0265 0.4031 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0032 0.0109 0.5
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0035 0.0144 0.0144
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0035 0.0144 0.0075
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0035 0.0144 0.0305
Brugia malayi nuclear receptor NHR-88 0.0035 0.0144 0.0275
Onchocerca volvulus 0.0136 0.1848 1
Schistosoma mansoni alpha glucosidase 0.0032 0.0109 0.004
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0082 0.0948 0.7528
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0035 0.0144 0.0305
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0035 0.0144 0.0144
Loa Loa (eye worm) hypothetical protein 0.0181 0.2606 0.5521
Trypanosoma cruzi DNA polymerase eta, putative 0.0037 0.018 1
Schistosoma mansoni tar DNA-binding protein 0.0231 0.3458 0.3412
Echinococcus multilocularis ecdysone induced protein 78C 0.0035 0.0144 0.0144
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0082 0.0948 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0032 0.0109 0.3914
Brugia malayi hypothetical protein 0.0136 0.1848 0.3691
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.003 0.007 0.007
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0152 0.2123 0.2123
Mycobacterium ulcerans aldehyde dehydrogenase 0.01 0.1247 0.0968
Echinococcus granulosus tumor protein p63 0.0341 0.5303 0.5303
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0035 0.0144 0.0075
Trypanosoma brucei DNA polymerase eta, putative 0.0037 0.018 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0035 0.0144 0.0275
Mycobacterium ulcerans aldehyde dehydrogenase 0.01 0.1247 0.0968
Loa Loa (eye worm) hypothetical protein 0.0035 0.0144 0.0305
Brugia malayi TAR-binding protein 0.0231 0.3458 0.6918
Schistosoma mansoni aldehyde dehydrogenase 0.01 0.1247 0.1185
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0243 0.3663 0.776
Echinococcus granulosus lysosomal alpha glucosidase 0.0146 0.2026 0.2026
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.003 0.007 0.007
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0057 0.0525 0.0525
Onchocerca volvulus 0.005 0.0403 0.1517
Brugia malayi photoreceptor-specific nuclear receptor 0.0035 0.0144 0.0275
Loa Loa (eye worm) hypothetical protein 0.0304 0.4688 0.993
Leishmania major alpha glucosidase II subunit, putative 0.0032 0.0109 0.0114
Echinococcus multilocularis musashi 0.0054 0.0469 0.0469
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0089 0.1065 0.1065
Mycobacterium ulcerans aldehyde dehydrogenase 0.01 0.1247 0.0968
Schistosoma mansoni DNA polymerase eta 0.0037 0.018 0.0111
Brugia malayi cytoplasmic intermediate filament protein 0.0029 0.0048 0.0083
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0097 0.1194 0.1194
Schistosoma mansoni tar DNA-binding protein 0.0231 0.3458 0.3412
Loa Loa (eye worm) isocitrate dehydrogenase 0.003 0.007 0.0147
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0082 0.0948 0.0948
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0035 0.0144 0.0144
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0082 0.0948 0.0948
Brugia malayi Steroid receptor seven-up type 2 0.0035 0.0144 0.0275
Loa Loa (eye worm) transcription factor SMAD2 0.0107 0.1358 0.2878
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0089 0.1065 0.1065
Schistosoma mansoni lamin 0.0054 0.0469 0.0403
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0181 0.2606 0.5211
Schistosoma mansoni thyroid hormone receptor 0.0187 0.2705 0.2654
Schistosoma mansoni hypothetical protein 0.0057 0.0525 0.0459
Brugia malayi ecdysteroid receptor 0.0035 0.0144 0.0275
Echinococcus multilocularis geminin 0.0429 0.6787 0.6787
Brugia malayi isocitrate dehydrogenase 0.003 0.007 0.0126
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.003 0.007 0.007
Brugia malayi Intermediate filament tail domain containing protein 0.0054 0.0469 0.0928
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0035 0.0144 0.0275
Loa Loa (eye worm) cytochrome P450 family protein 0.0026 0.0007 0.0014
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.003 0.007 0.0329
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.003 0.007 0.052
Loa Loa (eye worm) hypothetical protein 0.0035 0.0144 0.0305
Schistosoma mansoni tar DNA-binding protein 0.0231 0.3458 0.3412
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0035 0.0144 0.0275
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0089 0.1065 0.1065
Echinococcus granulosus geminin 0.0429 0.6787 0.6787
Trichomonas vaginalis alpha-glucosidase, putative 0.0032 0.0109 0.5
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0082 0.0948 0.7528
Loa Loa (eye worm) MH2 domain-containing protein 0.0107 0.1358 0.2878
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0032 0.0109 0.0574
Schistosoma mansoni jumonji/arid domain-containing protein 0.0097 0.1194 0.1132
Loa Loa (eye worm) hypothetical protein 0.0035 0.0144 0.0305
Trypanosoma brucei isocitrate dehydrogenase, putative 0.003 0.007 0.052
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0142 0.1958 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0144 0.0305
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0265 0.4031 0.8067
Loa Loa (eye worm) TAR-binding protein 0.0231 0.3458 0.7325
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0057 0.0525 0.0525
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0035 0.0144 0.0144
Echinococcus multilocularis peptidase Clp (S14 family) 0.0054 0.0471 0.0471
Schistosoma mansoni RAR-like nuclear receptor 0.0035 0.0144 0.0075
Brugia malayi Nuclear hormone receptor-like 1 0.0322 0.4995 1
Trypanosoma cruzi hypothetical protein, conserved 0.0032 0.0109 0.3914
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0035 0.0144 0.0144
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.003 0.007 0.007
Brugia malayi nuclear hormone receptor 0.0035 0.0144 0.0275
Schistosoma mansoni aldehyde dehydrogenase 0.01 0.1247 0.1185
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0035 0.0144 0.0275
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0265 0.4031 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0035 0.0144 0.0144
Schistosoma mansoni alpha-glucosidase 0.0126 0.1683 0.1625
Echinococcus multilocularis dna polymerase eta 0.0037 0.018 0.018
Trichomonas vaginalis alpha-glucosidase, putative 0.0032 0.0109 0.5
Brugia malayi Probable ClpP-like protease 0.0082 0.0948 0.1887
Brugia malayi Latrophilin receptor protein 2 0.0057 0.0525 0.104
Leishmania major DNA polymerase eta, putative 0.0037 0.018 0.0292
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0029 0.0048 0.0102
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0035 0.0144 0.0075
Brugia malayi hypothetical protein 0.003 0.0064 0.0114
Echinococcus granulosus dna polymerase eta 0.0037 0.018 0.018
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0082 0.0948 0.5
Schistosoma mansoni tar DNA-binding protein 0.0231 0.3458 0.3412
Echinococcus granulosus FTZ F1 alpha 0.0035 0.0144 0.0144
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.003 0.007 0.007
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0035 0.0144 0.0305
Schistosoma mansoni hypothetical protein 0.0429 0.6787 0.6765
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0035 0.0144 0.0144
Echinococcus granulosus GPCR family 2 0.0057 0.0525 0.0525
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0035 0.0144 0.0275
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0032 0.0109 0.0231
Schistosoma mansoni jumonji/arid domain-containing protein 0.0097 0.1194 0.1132
Echinococcus granulosus neutral alpha glucosidase AB 0.0032 0.0109 0.0109
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0152 0.2123 0.2123
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0064 0.0263
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0265 0.4031 0.4031
Echinococcus multilocularis tumor protein p63 0.0341 0.5303 0.5303
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0089 0.1065 0.1002
Brugia malayi latrophilin 2 splice variant baaae 0.0124 0.1643 0.328
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0054 0.0469 0.0994
Schistosoma mansoni alpha-glucosidase 0.0126 0.1683 0.1625
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0082 0.0948 1
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0082 0.0948 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0035 0.0144 0.0305
Onchocerca volvulus 0.0054 0.0469 0.191
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0089 0.1065 0.2256
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0035 0.0144 0.0075
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0607 0.9792 0.9792
Schistosoma mansoni hypothetical protein 0.0057 0.0525 0.0459
Schistosoma mansoni peptidase Clp (S14 family) 0.0082 0.0948 0.0885
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0089 0.1065 0.1065
Echinococcus multilocularis microtubule associated protein 2 0.062 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0035 0.0144 0.0305
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0265 0.4031 1
Echinococcus multilocularis neutral alpha glucosidase AB 0.0032 0.0109 0.0109
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0035 0.0144 0.0144
Echinococcus multilocularis lamin dm0 0.0054 0.0469 0.0469
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0035 0.0144 0.0275
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0054 0.0471 0.1012
Loa Loa (eye worm) hypothetical protein 0.0082 0.0948 0.2009
Schistosoma mansoni cellular tumor antigen P53 0.005 0.0403 0.0335
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0035 0.0144 0.0275
Loa Loa (eye worm) hypothetical protein 0.0035 0.0144 0.0305
Echinococcus granulosus ecdysone induced protein 78C 0.0035 0.0144 0.0144
Brugia malayi Nuclear hormone receptor-like 1 0.0306 0.4721 0.945
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0035 0.0144 0.0144
Echinococcus granulosus tar DNA binding protein 0.0231 0.3458 0.3458
Echinococcus granulosus peptidase Clp S14 family 0.0054 0.0471 0.0471
Brugia malayi steroid hormone receptor 0.0035 0.0144 0.0275
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0306 0.4721 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.018 0.038
Brugia malayi RNA binding protein 0.0231 0.3458 0.6918
Loa Loa (eye worm) hypothetical protein 0.005 0.0403 0.0853
Brugia malayi MH2 domain containing protein 0.0107 0.1358 0.271
Echinococcus multilocularis lysosomal alpha glucosidase 0.0146 0.2026 0.2026
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.01 0.1247 0.2982
Loa Loa (eye worm) hypothetical protein 0.0035 0.0144 0.0305
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0035 0.0144 0.0075
Schistosoma mansoni hypothetical protein 0.0429 0.6787 0.6765
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0035 0.0144 0.0144
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.01 0.1247 0.2971
Schistosoma mansoni coup transcription factor 0.0035 0.0144 0.0075
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0032 0.0109 0.5
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0035 0.0144 0.0275
Brugia malayi ImpB/MucB/SamB family protein 0.0037 0.018 0.0347
Echinococcus multilocularis thyroid hormone receptor alpha 0.0187 0.2705 0.2705
Echinococcus granulosus lamin dm0 0.0054 0.0469 0.0469
Schistosoma mansoni steroid hormone receptor ad4bp 0.0035 0.0144 0.0075
Schistosoma mansoni lamin 0.0054 0.0469 0.0403
Loa Loa (eye worm) hypothetical protein 0.003 0.0064 0.0135
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.003 0.007 0.0015
Schistosoma mansoni hypothetical protein 0.0057 0.0525 0.0459
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0146 0.2026 0.4293
Echinococcus granulosus lysine specific demethylase 5A 0.0097 0.1194 0.1194
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0181 0.2606 0.5521
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0054 0.0471 0.1012
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0082 0.0948 1
Schistosoma mansoni tar DNA-binding protein 0.0231 0.3458 0.3412
Loa Loa (eye worm) hypothetical protein 0.0142 0.1958 0.4149
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0057 0.0525 0.0525
Echinococcus multilocularis lamin 0.0054 0.0469 0.0469
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0057 0.0525 0.104
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0035 0.0144 0.0144
Schistosoma mansoni hypothetical protein 0.0152 0.2123 0.2068
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.003 0.007 0.052
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0035 0.0144 0.0305
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0089 0.1065 0.2121
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0035 0.0144 0.0275
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0035 0.0144 0.0144
Loa Loa (eye worm) hypothetical protein 0.0035 0.0144 0.0305
Brugia malayi Glycosyl hydrolases family 31 protein 0.0032 0.0109 0.0205
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0089 0.1065 0.1002
Loa Loa (eye worm) RNA binding protein 0.0231 0.3458 0.7325
Echinococcus multilocularis FTZ F1 alpha 0.0035 0.0144 0.0144
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.01 0.1247 0.1247
Echinococcus multilocularis GPCR, family 2 0.0057 0.0525 0.0525
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0054 0.0471 0.4744
Brugia malayi Calcitonin receptor-like protein seb-1 0.0181 0.2606 0.5211
Brugia malayi Glycosyl hydrolases family 31 protein 0.0146 0.2026 0.4049
Echinococcus multilocularis tar DNA binding protein 0.0231 0.3458 0.3458
Brugia malayi Isocitrate dehydrogenase 0.003 0.007 0.0126
Toxoplasma gondii isocitrate dehydrogenase 0.003 0.007 0.0248
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0082 0.0948 0.5
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0265 0.4031 0.4031
Schistosoma mansoni intermediate filament proteins 0.0054 0.0469 0.0403
Echinococcus multilocularis lysine specific demethylase 5A 0.0097 0.1194 0.1194
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0035 0.0144 0.0275
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0057 0.0525 0.0525
Loa Loa (eye worm) hypothetical protein 0.0053 0.0453 0.0959
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0064 0.0263
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0035 0.0144 0.0144

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 1 % Hair growth stimulatory activity in C3H/HeN mouse treated 5 days a week topically to shaved lower back twice daily for 4 weeks ChEMBL. 19900809
Ki (binding) = 0.5 nM Binding affinity to thyroid receptor beta ChEMBL. 19900809
Ki (binding) = 0.7 nM Binding affinity to thyroid receptor alpha ChEMBL. 19900809
Potency (functional) 48.9662 uM PubChem BioAssay: Tox21. qHTS assay to identify small molecule agonists of the NFkB signaling pathway. (Class of assay: confirmatory) ChEMBL. No reference

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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