Detailed information for compound 1389887

Basic information

Technical information
  • TDR Targets ID: 1389887
  • Name: NCGC00165133-01
  • MW: 409.453 | Formula: C23H24FN3O3
  • H donors: 0 H acceptors: 2 LogP: 4.2 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)c1cnc2c(c1N1CCN(CC1)c1ccccc1F)cccc2OC
  • InChi: 1S/C23H24FN3O3/c1-3-30-23(28)17-15-25-21-16(7-6-10-20(21)29-2)22(17)27-13-11-26(12-14-27)19-9-5-4-8-18(19)24/h4-10,15H,3,11-14H2,1-2H3
  • InChiKey: FGIYNSOZTOFNTM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Equus caballus Ferritin light chain Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 43.9 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 44.4 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 142 aa 29.6 %
Echinococcus granulosus expressed protein Ferritin light chain   175 aa 146 aa 28.8 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 146 aa 28.8 %
Schistosoma japonicum Ferritin, putative Ferritin light chain   175 aa 144 aa 24.3 %
Echinococcus multilocularis expressed protein Ferritin light chain   175 aa 146 aa 30.1 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0059 0.0056
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0053 0.0233 0.0213
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0113 0.0614 0.0595
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0113 0.0614 0.0857
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0381 0.0362
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0113 0.0614 0.0619
Trypanosoma cruzi DNA polymerase eta, putative 0.0033 0.0101 0.0116
Schistosoma mansoni hypothetical protein 0.0043 0.017 0.015
Echinococcus granulosus transcription factor Dp 1 0.0639 0.3979 0.3967
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0195 0.0176
Brugia malayi nuclear receptor RXR 0.006 0.0273 0.0393
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0113 0.0614 0.0857
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0113 0.0614 0.0883
Brugia malayi conserved hypotetical protein 0.0053 0.0233 0.0335
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0113 0.0614 0.0619
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Echinococcus granulosus dna polymerase eta 0.0046 0.0189 0.0169
Brugia malayi ecdysone receptor 0.0053 0.0233 0.0335
Schistosoma mansoni zinc finger protein 0.0053 0.0233 0.0213
Schistosoma mansoni thyroid hormone receptor 0.0113 0.0614 0.0595
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0113 0.0614 0.0595
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0053 0.0233 0.0221
Trypanosoma cruzi DNA polymerase eta, putative 0.0046 0.0189 0.0243
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0195 0.0176
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0059 0.0056
Schistosoma mansoni retinoic acid receptor RXR 0.1581 1 1
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.1104 0.6952 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0381 0.0362
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0113 0.0614 0.0619
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0027 0.0065 0.1335
Mycobacterium ulcerans DNA polymerase IV 0.002 0.002 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0053 0.0233 0.0213
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0027 0.0065 0.0064
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Echinococcus granulosus geminin 0.0176 0.1015 0.0997
Brugia malayi Nuclear hormone receptor E75 0.0053 0.0233 0.0335
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.1104 0.6952 0.6946
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0113 0.0614 0.0883
Loa Loa (eye worm) hypothetical protein 0.0113 0.0614 0.0857
Entamoeba histolytica hypothetical protein 0.0043 0.017 0.0216
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.006 0.0273 0.0254
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0113 0.0614 0.0883
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0113 0.0614 0.0883
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0113 0.0614 0.0595
Loa Loa (eye worm) DR-78 0.0053 0.0233 0.0307
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0381 0.0362
Brugia malayi nuclear hormone receptor family member odr-7 0.0053 0.0233 0.0335
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0113 0.0614 0.0883
Brugia malayi MH2 domain containing protein 0.0144 0.0814 0.1171
Brugia malayi TAR-binding protein 0.0076 0.0381 0.0549
Loa Loa (eye worm) hypothetical protein 0.006 0.0273 0.0366
Brugia malayi Nuclear hormone receptor-like 1 0.006 0.0273 0.0393
Echinococcus granulosus Nuclear hormone receptor HR96 0.0053 0.0233 0.0213
Echinococcus multilocularis ecdysone induced protein 78C 0.0113 0.0614 0.0619
Schistosoma mansoni hypothetical protein 0.0176 0.1015 0.0997
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0113 0.0614 0.0619
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0113 0.0614 0.0883
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0113 0.0614 0.0595
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0113 0.0614 0.0619
Loa Loa (eye worm) steroid hormone receptor 0.0113 0.0614 0.0857
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Brugia malayi nuclear receptor NHR-67 0.0053 0.0233 0.0335
Echinococcus granulosus FTZ F1 alpha 0.0113 0.0614 0.0595
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.1104 0.6952 1
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0033 0.0101 1
Brugia malayi hypothetical protein 0.0053 0.0233 0.0335
Echinococcus granulosus ecdysone induced protein 78C 0.0113 0.0614 0.0595
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.1104 0.6952 1
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.0814 0.1146
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0053 0.0233 0.0221
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0113 0.0614 0.0857
Loa Loa (eye worm) flap endonuclease-1 0.0027 0.0065 0.0064
Echinococcus granulosus tar DNA binding protein 0.0076 0.0381 0.0362
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0027 0.0065 0.0064
Plasmodium falciparum flap endonuclease 1 0.0027 0.0065 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0113 0.0614 0.0857
Brugia malayi nuclear receptor RXR 0.0053 0.0233 0.0335
Brugia malayi nuclear receptor NHR-88 0.0053 0.0233 0.0335
Giardia lamblia Flap structure-specific endonuclease 0.0027 0.0065 1
Trypanosoma brucei DNA polymerase eta, putative 0.0046 0.0189 0.0243
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0113 0.0614 0.0857
Loa Loa (eye worm) hypothetical protein 0.0113 0.0614 0.0857
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.006 0.0273 0.0254
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0113 0.0614 0.0857
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.1104 0.6952 1
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0053 0.0233 0.0213
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0195 0.0183
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.017 0.0156
Echinococcus multilocularis dna polymerase eta 0.0046 0.0189 0.0176
Echinococcus multilocularis geminin 0.0176 0.1015 0.1037
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0113 0.0614 0.0595
Brugia malayi hypothetical protein 0.0053 0.0233 0.0335
Echinococcus multilocularis nuclear receptor nhr 48 0.0053 0.0233 0.0221
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0195 0.0176
Brugia malayi nuclear receptor NHR-88 0.0113 0.0614 0.0883
Loa Loa (eye worm) hypothetical protein 0.006 0.0273 0.0366
Echinococcus granulosus flap endonuclease 1 0.0027 0.0065 0.0045
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.1104 0.6952 0.7222
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0113 0.0614 0.0595
Loa Loa (eye worm) hypothetical protein 0.0113 0.0614 0.0857
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0113 0.0614 0.0595
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0195 0.0281
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.002 0.0029
Echinococcus multilocularis FTZ F1 alpha 0.0113 0.0614 0.0619
Schistosoma mansoni DNA polymerase eta 0.0046 0.0189 0.0169
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0381 0.0362
Echinococcus granulosus thyroid hormone receptor alpha 0.0053 0.0233 0.0213
Loa Loa (eye worm) hypothetical protein 0.0113 0.0614 0.0857
Schistosoma mansoni hypothetical protein 0.0176 0.1015 0.0997
Schistosoma mansoni nuclear hormone receptor 0.0053 0.0233 0.0213
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Entamoeba histolytica Flap nuclease, putative 0.0027 0.0065 0.0064
Onchocerca volvulus Bile acid receptor homolog 0.0113 0.0614 1
Plasmodium vivax flap endonuclease 1, putative 0.0027 0.0065 1
Brugia malayi Steroid receptor seven-up type 2 0.0113 0.0614 0.0883
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.006 0.0273 0.0264
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.1104 0.6952 1
Loa Loa (eye worm) hypothetical protein 0.0113 0.0614 0.0857
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0113 0.0614 0.0595
Echinococcus granulosus Nuclear hormone receptor HR96 0.0053 0.0233 0.0213
Mycobacterium tuberculosis Conserved hypothetical protein 0.002 0.002 0.5
Brugia malayi nuclear hormone receptor 0.0053 0.0233 0.0335
Brugia malayi Flap endonuclease-1 0.0027 0.0065 0.0093
Entamoeba histolytica hypothetical protein 0.0043 0.017 0.0216
Brugia malayi hypothetical protein 0.006 0.0273 0.0393
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0113 0.0614 0.0595
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0053 0.0233 0.0213
Brugia malayi Nuclear hormone receptor E75 0.0053 0.0233 0.0335
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0113 0.0614 0.0883
Schistosoma mansoni nuclear receptor nhr-48 0.0053 0.0233 0.0213
Loa Loa (eye worm) hypothetical protein 0.0026 0.0059 0.0056
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0113 0.0614 0.0595
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0053 0.0233 0.0307
Loa Loa (eye worm) hypothetical protein 0.0113 0.0614 0.0857
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0195 0.0253
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0113 0.0614 0.0883
Loa Loa (eye worm) hypothetical protein 0.0113 0.0614 0.0857
Loa Loa (eye worm) hypothetical protein 0.006 0.0273 0.0366
Brugia malayi RNA binding protein 0.0076 0.0381 0.0549
Brugia malayi photoreceptor-specific nuclear receptor 0.0113 0.0614 0.0883
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0027 0.0065 0.0064
Leishmania major DNA polymerase eta, putative 0.0033 0.0101 0.0116
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0113 0.0614 1
Echinococcus multilocularis transcription factor Dp 1 0.0639 0.3979 0.4124
Onchocerca volvulus 0.0113 0.0614 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0113 0.0614 0.0883
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0113 0.0614 0.0883
Echinococcus multilocularis tar DNA binding protein 0.0076 0.0381 0.0376
Schistosoma mansoni flap endonuclease-1 0.0024 0.0048 0.0028
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0053 0.0233 0.0221
Echinococcus multilocularis thyroid hormone receptor alpha 0.0113 0.0614 0.0619
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.0381 0.0549
Leishmania major hypothetical protein, conserved 0.0026 0.0059 0.0056
Brugia malayi tailless protein 0.0053 0.0233 0.0335
Loa Loa (eye worm) hypothetical protein 0.0113 0.0614 0.0857
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0113 0.0614 0.0595
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0059 0.0056
Loa Loa (eye worm) RNA binding protein 0.0076 0.0381 0.0521
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Loa Loa (eye worm) TAR-binding protein 0.0076 0.0381 0.0521
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.0814 0.1146
Echinococcus granulosus nuclear receptor nhr 48 0.0053 0.0233 0.0213
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0113 0.0614 0.0595
Loa Loa (eye worm) hypothetical protein 0.006 0.0273 0.0366
Loa Loa (eye worm) nuclear hormone receptor 0.0053 0.0233 0.0307
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0113 0.0614 0.0857
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0195 0.0176
Trichomonas vaginalis flap endonuclease-1, putative 0.0027 0.0065 1
Schistosoma mansoni nuclear receptor 0.0053 0.0233 0.0213
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0113 0.0614 0.0619
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0113 0.0614 0.0883
Entamoeba histolytica hypothetical protein 0.0043 0.017 0.0216
Brugia malayi nuclear hormone receptor family member nhr-6 0.0053 0.0233 0.0335
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.017 0.015
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0053 0.0233 0.0221
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0053 0.0233 0.0335
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.1104 0.6952 0.6946
Brugia malayi ImpB/MucB/SamB family protein 0.0046 0.0189 0.0272
Echinococcus multilocularis flap endonuclease 1 0.0027 0.0065 0.0047
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.1104 0.6952 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0381 0.0362
Schistosoma mansoni nuclear hormone receptor 0.0113 0.0614 0.0595
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.002 0.002 0.5
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0113 0.0614 0.0883
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.017 0.015
Brugia malayi ecdysteroid receptor 0.0113 0.0614 0.0883
Schistosoma mansoni steroid hormone receptor ad4bp 0.0113 0.0614 0.0595
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Loa Loa (eye worm) nuclear receptor NHR-67 0.0053 0.0233 0.0307
Brugia malayi nuclear hormone receptor 0.0113 0.0614 0.0883
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0195 0.0183
Schistosoma mansoni nuclear receptor 0.0053 0.0233 0.0213
Loa Loa (eye worm) hypothetical protein 0.0046 0.0189 0.0243
Brugia malayi hypothetical protein 0.0043 0.017 0.0245
Leishmania major DNA polymerase eta, putative 0.0046 0.0189 0.0243
Brugia malayi Nuclear hormone receptor-like 1 0.006 0.0273 0.0393
Brugia malayi hypothetical protein 0.006 0.0273 0.0393
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0195 0.0176
Brugia malayi orphan nuclear receptor NR2E1 0.0053 0.0233 0.0335
Onchocerca volvulus Protein ultraspiracle homolog 0.0113 0.0614 1
Entamoeba histolytica hypothetical protein 0.0043 0.017 0.0216
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.0381 0.0521
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.006 0.0273 0.0366
Schistosoma mansoni retinoid-x-receptor (RXR) 0.006 0.0273 0.0254
Schistosoma mansoni nuclear hormone receptor 0.0053 0.0233 0.0213
Brugia malayi steroid hormone receptor 0.0113 0.0614 0.0883
Loa Loa (eye worm) hypothetical protein 0.006 0.0273 0.0366
Loa Loa (eye worm) hypothetical protein 0.0053 0.0233 0.0307
Schistosoma mansoni thyroid hormone receptor 0.0113 0.0614 0.0595
Mycobacterium ulcerans DNA polymerase IV 0.002 0.002 0.5
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0113 0.0614 0.0883
Brugia malayi hypothetical protein 0.0026 0.0059 0.0085
Schistosoma mansoni RAR-like nuclear receptor 0.0113 0.0614 0.0595
Brugia malayi Nuclear hormone receptor-like 1 0.0113 0.0614 0.0883
Schistosoma mansoni coup transcription factor 0.0113 0.0614 0.0595
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.1104 0.6952 1
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.1521 0.9619 1

Activities

Activity type Activity value Assay description Source Reference
Potency (binding) = 8.9125 um PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)] ChEMBL. No reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 11.2202 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 12.5893 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 15.8489 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 16.3601 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (binding) = 25.1189 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 28.1838 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 28.1838 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 31.6228 uM PubChem BioAssay. A Novel Cell-Based Assay to Identify Small Molecules for B -Galactocerebrosidase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 50.1187 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23

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

No literature references available for this target.

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