Detailed information for compound 830515

Basic information

Technical information
  • TDR Targets ID: 830515
  • Name: N-[(4-methoxyphenyl)methyl]-1-(7-methyl-5-oxo -[1,3,4]thiadiazolo[4,5-a]pyrimidin-2-yl)pipe ridine-4-carboxamide
  • MW: 413.493 | Formula: C20H23N5O3S
  • H donors: 1 H acceptors: 2 LogP: 1.85 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)CNC(=O)C1CCN(CC1)c1nn2c(s1)nc(cc2=O)C
  • InChi: 1S/C20H23N5O3S/c1-13-11-17(26)25-19(22-13)29-20(23-25)24-9-7-15(8-10-24)18(27)21-12-14-3-5-16(28-2)6-4-14/h3-6,11,15H,7-10,12H2,1-2H3,(H,21,27)
  • InChiKey: OXEJZVWYNQRYST-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[(4-methoxyphenyl)methyl]-1-(7-methyl-5-oxo-[1,3,4]thiadiazolo[4,5-a]pyrimidin-2-yl)-4-piperidinecarboxamide
  • 1-(5-keto-7-methyl-[1,3,4]thiadiazolo[4,5-a]pyrimidin-2-yl)-N-(4-methoxybenzyl)isonipecotamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens muscleblind-like splicing regulator 1 Starlite/ChEMBL No references
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references
Homo sapiens glycoprotein hormones, alpha polypeptide Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi Muscleblind-like protein Get druggable targets OG5_132352 All targets in OG5_132352
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus muscleblind protein Get druggable targets OG5_132352 All targets in OG5_132352
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis muscleblind protein Get druggable targets OG5_132352 All targets in OG5_132352
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132352 All targets in OG5_132352
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis muscleblind protein 1 Get druggable targets OG5_132352 All targets in OG5_132352
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium yoelii putative AP endonuclease-related Get druggable targets OG5_126768 All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132352 All targets in OG5_132352
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Toxoplasma gondii intraflagellar transport protein 172, putative glycoprotein hormones, alpha polypeptide 116 aa 94 aa 26.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus transcription factor btf3 0.0034 0.0935 0.0844
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.0426 0.0321
Echinococcus granulosus survival motor neuron protein 1 0.0229 0.9827 1
Loa Loa (eye worm) Smad1 0.0016 0.0114 0.0114
Brugia malayi steroid hormone receptor 0.0021 0.0338 0.0338
Schistosoma mansoni patched 1 0.0041 0.1256 0.2041
Loa Loa (eye worm) hypothetical protein 0.0041 0.1274 0.1274
Trypanosoma cruzi ISWI complex protein 0.0015 0.0067 0.0715
Schistosoma mansoni thyroid hormone receptor 0.0143 0.5893 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0338 0.0338
Loa Loa (eye worm) MH1 domain-containing protein 0.0016 0.0114 0.0114
Echinococcus granulosus ecdysone induced protein 78C 0.0021 0.0338 0.023
Loa Loa (eye worm) hypothetical protein 0.0021 0.0338 0.0338
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0935 0.6127
Brugia malayi MH2 domain containing protein 0.0016 0.0114 0.0114
Echinococcus multilocularis expressed conserved protein 0.009 0.3473 0.3458
Loa Loa (eye worm) hypothetical protein 0.018 0.7606 0.7606
Echinococcus granulosus Niemann Pick C1 protein 0.0095 0.3736 0.3729
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0338 0.0338
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0095 0.3736 1
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0016 0.0114 0.0082
Entamoeba histolytica hypothetical protein 0.0074 0.2759 0.7047
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0338 0.0338
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0021 0.0338 0.0465
Loa Loa (eye worm) MH2 domain-containing protein 0.0016 0.0114 0.0114
Schistosoma mansoni smad1 5 8 and 0.0016 0.0114 0.0082
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0021 0.0338 0.0465
Schistosoma mansoni ap endonuclease 0.0023 0.0426 0.0616
Schistosoma mansoni ap endonuclease 0.0023 0.0426 0.0616
Echinococcus multilocularis FTZ F1 alpha 0.0021 0.0338 0.023
Schistosoma mansoni hypothetical protein 0.0074 0.2759 0.462
Loa Loa (eye worm) hypothetical protein 0.0021 0.0338 0.0338
Schistosoma mansoni steroid hormone receptor ad4bp 0.0021 0.0338 0.0465
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0338 0.023
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0021 0.0338 0.0338
Loa Loa (eye worm) steroid hormone receptor 0.0021 0.0338 0.0338
Schistosoma mansoni hypothetical protein 0.0039 0.1189 0.1926
Toxoplasma gondii NAC domain-containing protein 0.0034 0.0935 1
Schistosoma mansoni hypothetical protein 0.0039 0.1189 0.1926
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0935 0.6127
Leishmania major basic transcription factor 3a, putative 0.0034 0.0935 1
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0122 0.4947 0.4976
Echinococcus multilocularis survival motor neuron protein 1 0.0229 0.9827 1
Entamoeba histolytica hypothetical protein 0.0074 0.2759 0.7047
Echinococcus multilocularis ecdysone induced protein 78C 0.0021 0.0338 0.023
Echinococcus multilocularis muscleblind protein 1 0.018 0.7606 0.7714
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0058 0.2026 0.1968
Entamoeba histolytica hypothetical protein 0.0074 0.2759 0.7047
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0338 0.0338
Leishmania major hypothetical protein, conserved 0.0015 0.0067 0.0715
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0338 0.023
Echinococcus granulosus histone lysine methyltransferase setb 0.0017 0.0144 0.0031
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0021 0.0338 0.0338
Brugia malayi beta-NAC-like protein 0.0034 0.0935 0.0935
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0302 0.0302
Loa Loa (eye worm) ICD-1 protein 0.0034 0.0935 0.0935
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0021 0.0338 0.0338
Loa Loa (eye worm) hypothetical protein 0.0229 0.9827 0.9827
Echinococcus multilocularis zinc finger protein 0.0019 0.0256 0.0145
Loa Loa (eye worm) hypothetical protein 0.0021 0.0338 0.0338
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0426 0.0426
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0041 0.1256 0.1256
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.0144 0.0031
Echinococcus granulosus FTZ F1 alpha 0.0021 0.0338 0.023
Echinococcus multilocularis Niemann Pick C1 protein 0.0136 0.5601 0.5649
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0017 0.0144 0.0031
Schistosoma mansoni hypothetical protein 0.002 0.0302 0.0404
Schistosoma mansoni smad 0.0016 0.0114 0.0082
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0058 0.2026 0.1968
Entamoeba histolytica hypothetical protein 0.0074 0.2759 0.7047
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0144 0.0133
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0021 0.0338 0.0338
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.0426 0.4557
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0144 0.0133
Echinococcus granulosus expressed conserved protein 0.009 0.3473 0.3458
Schistosoma mansoni Smad4 0.0016 0.0114 0.0082
Echinococcus multilocularis transcription factor btf3 0.0034 0.0935 0.0844
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.0426 0.4557
Brugia malayi Bromodomain containing protein 0.0037 0.1082 0.1082
Schistosoma mansoni hypothetical protein 0.0039 0.1189 0.1926
Trypanosoma cruzi transcription factor btf3, putative 0.0034 0.0935 1
Schistosoma mansoni coup transcription factor 0.0021 0.0338 0.0465
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0021 0.0338 0.0465
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0338 0.0338
Schistosoma mansoni smad1 5 8 and 0.0016 0.0114 0.0082
Echinococcus granulosus zinc finger protein 0.0019 0.0256 0.0145
Loa Loa (eye worm) hypothetical protein 0.0021 0.0338 0.0338
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0021 0.0338 0.0465
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0021 0.0338 0.023
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0122 0.4947 0.4976
Brugia malayi MH1 domain containing protein 0.0016 0.0114 0.0114
Loa Loa (eye worm) hypothetical protein 0.0021 0.0338 0.0338
Loa Loa (eye worm) hypothetical protein 0.0021 0.0338 0.0338
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0074 0.2759 0.2722
Schistosoma mansoni retinoic acid receptor RXR 0.0021 0.0338 0.0465
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0021 0.0338 0.023
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.0144 0.0031
Loa Loa (eye worm) hypothetical protein 0.0069 0.2513 0.2513
Schistosoma mansoni hypothetical protein 0.0122 0.4947 0.8377
Brugia malayi hypothetical protein 0.0074 0.2759 0.2759
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0021 0.0338 0.023
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0021 0.0338 0.0338
Loa Loa (eye worm) transcription factor SMAD2 0.0233 1 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0338 0.023
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0021 0.0338 0.023
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0021 0.0338 0.0338
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.152 0.152
Schistosoma mansoni smad1 5 8 and 0.0016 0.0114 0.0082
Loa Loa (eye worm) hypothetical protein 0.0021 0.0338 0.0338
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0021 0.0338 0.0338
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0023 0.0426 0.5
Echinococcus multilocularis protein patched 0.0041 0.1256 0.1175
Schistosoma mansoni RAR-like nuclear receptor 0.0021 0.0338 0.0465
Brugia malayi nuclear hormone receptor 0.0021 0.0338 0.0338
Loa Loa (eye worm) MH2 domain-containing protein 0.0233 1 1
Brugia malayi CHE-14 protein 0.0041 0.1256 0.1256
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0097 0.3804 0.6414
Brugia malayi Muscleblind-like protein 0.018 0.7606 0.7606
Echinococcus granulosus sterol regulatory element binding protein 0.0041 0.1256 0.1175
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.0426 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0935 0.6127
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0021 0.0338 0.023
Echinococcus granulosus Niemann Pick C1 protein 0.0136 0.5601 0.5649
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0023 0.0426 0.5
Echinococcus multilocularis thyroid hormone receptor alpha 0.0143 0.5893 0.595
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0171 0.0171
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0021 0.0338 0.023
Schistosoma mansoni hypothetical protein 0.0047 0.152 0.2494
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0977 0.0888
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0021 0.0338 0.0465
Brugia malayi MH2 domain containing protein 0.0016 0.0114 0.0114
Brugia malayi Steroid receptor seven-up type 2 0.0021 0.0338 0.0338
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0021 0.0338 0.0338
Onchocerca volvulus 0.0047 0.152 1
Brugia malayi nuclear receptor NHR-88 0.0021 0.0338 0.0338
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.1256 1
Brugia malayi Niemann-Pick C1 protein precursor 0.0095 0.3736 0.3736
Loa Loa (eye worm) hypothetical protein 0.0095 0.3736 0.3736
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0338 0.023
Brugia malayi Smad1 0.0016 0.0114 0.0114
Plasmodium vivax basic transcription factor 3b, putative 0.0034 0.0935 1
Echinococcus multilocularis muscleblind protein 0.018 0.7606 0.7714
Brugia malayi Bromodomain containing protein 0.0073 0.2701 0.2701
Schistosoma mansoni hypothetical protein 0.0039 0.1189 0.1926
Trypanosoma cruzi transcription factor btf3, putative 0.0034 0.0935 1
Trypanosoma brucei ISWI complex protein 0.0015 0.0067 0.0715
Schistosoma mansoni thyroid hormone receptor 0.0143 0.5893 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0021 0.0338 0.0465
Brugia malayi photoreceptor-specific nuclear receptor 0.0021 0.0338 0.0338
Echinococcus multilocularis Niemann Pick C1 protein 0.0095 0.3736 0.3729
Loa Loa (eye worm) hypothetical protein 0.0021 0.0338 0.0338
Entamoeba histolytica transcription factor BTF3, putative 0.0034 0.0935 0.1537
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0021 0.0338 0.0338
Loa Loa (eye worm) hypothetical protein 0.018 0.7606 0.7606
Brugia malayi hypothetical protein 0.0229 0.9827 0.9827
Schistosoma mansoni survival motor neuron protein 0.0047 0.152 0.2494
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0426 0.0426
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0023 0.0426 1
Loa Loa (eye worm) hypothetical protein 0.005 0.1676 0.1676
Loa Loa (eye worm) hypothetical protein 0.0037 0.1085 0.1085
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.0426 0.0321
Plasmodium falciparum basic transcription factor 3b, putative 0.0034 0.0935 1
Schistosoma mansoni transcription factor btf3 0.0034 0.0935 0.1489
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0977 0.0888
Echinococcus multilocularis protein dispatched 1 0.0047 0.152 0.1447
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0021 0.0338 0.0338
Brugia malayi MH1 domain containing protein 0.0016 0.0114 0.0114
Loa Loa (eye worm) hypothetical protein 0.0017 0.0144 0.0144
Loa Loa (eye worm) hypothetical protein 0.0041 0.1256 0.1256
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.0426 0.4557
Echinococcus granulosus muscleblind protein 0.018 0.7606 0.7714
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0021 0.0338 0.0338
Schistosoma mansoni nuclear hormone receptor 0.0021 0.0338 0.0465
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0021 0.0338 0.023
Schistosoma mansoni transcription factor LCR-F1 0.0074 0.2759 0.462
Loa Loa (eye worm) hypothetical protein 0.0039 0.1189 0.1189
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0426 0.5
Schistosoma mansoni zinc finger protein 0.0019 0.0256 0.0324
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0338 0.0338
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0021 0.0338 0.023
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0021 0.0338 0.0338
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0021 0.0338 0.023
Entamoeba histolytica hypothetical protein 0.0034 0.0935 0.1537
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0387 0.0549
Brugia malayi ecdysteroid receptor 0.0021 0.0338 0.0338
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0144 0.0133
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0387 0.028
Trypanosoma cruzi ISWI complex protein 0.0015 0.0067 0.0715
Echinococcus granulosus Protein patched homolog 1 0.0041 0.1256 0.1175
Echinococcus multilocularis sterol regulatory element binding protein 0.0041 0.1256 0.1175
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0144 0.0133
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0021 0.0338 0.0338
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0387 0.028
Brugia malayi PHD-finger family protein 0.0024 0.0491 0.0491
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.0426 0.4557
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0074 0.2759 0.2722
Brugia malayi Nuclear hormone receptor-like 1 0.0021 0.0338 0.0338
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0021 0.0338 0.0338
Schistosoma mansoni bromodomain containing protein 0.0061 0.2184 0.3634
Trypanosoma brucei transcription factor BTF3, putative 0.0034 0.0935 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.2119 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 1 uM PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 4.1475 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (binding) 6.3096 uM PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum 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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