Detailed information for compound 1430009

Basic information

Technical information
  • TDR Targets ID: 1430009
  • Name: N-[4-[[(3-nitrobenzoyl)amino]carbamoyl]phenyl ]butanamide
  • MW: 370.359 | Formula: C18H18N4O5
  • H donors: 3 H acceptors: 5 LogP: 2.2 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCC(=O)Nc1ccc(cc1)C(=O)NNC(=O)c1cccc(c1)[N+](=O)[O-]
  • InChi: 1S/C18H18N4O5/c1-2-4-16(23)19-14-9-7-12(8-10-14)17(24)20-21-18(25)13-5-3-6-15(11-13)22(26)27/h3,5-11H,2,4H2,1H3,(H,19,23)(H,20,24)(H,21,25)
  • InChiKey: TXSBWPCMANWVTL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[4-[[N'-[(3-nitrophenyl)-oxomethyl]hydrazino]-oxomethyl]phenyl]butanamide
  • N-[4-[[(3-nitrobenzoyl)amino]carbamoyl]phenyl]butyramide
  • N-[4-[[(3-nitrophenyl)carbonylamino]carbamoyl]phenyl]butanamide
  • MLS000701410
  • N-{4-[(2-{3-nitrobenzoyl}hydrazino)carbonyl]phenyl}butanamide
  • SMR000228715
  • AN-329/40614817
  • ZINC00672498
  • ARONIS000288
  • STK082957

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens muscleblind-like splicing regulator 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis muscleblind protein Get druggable targets OG5_132352 All targets in OG5_132352
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132352 All targets in OG5_132352
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132352 All targets in OG5_132352
Echinococcus granulosus muscleblind protein Get druggable targets OG5_132352 All targets in OG5_132352
Brugia malayi Muscleblind-like protein Get druggable targets OG5_132352 All targets in OG5_132352
Echinococcus multilocularis muscleblind protein 1 Get druggable targets OG5_132352 All targets in OG5_132352
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0089 0.0134
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Loa Loa (eye worm) heterochromatin protein 1 0.0068 0.07 0.1945
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0159 0.2364
Echinococcus granulosus phosphatidylinositol 5 phosphate 4 kinase type 2 0.019 0.2246 0.7174
Echinococcus multilocularis phosphatidylinositol phosphate 5 kinase type III 0.0015 0.0036 0.003
Trichomonas vaginalis phosphatidylinositol-4-phosphate 5-kinase type II, putative 0.0015 0.0036 0.0042
Schistosoma mansoni tar DNA-binding protein 0.026 0.3129 0.869
Trypanosoma brucei unspecified product 0.0023 0.0129 0.0234
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Entamoeba histolytica hypothetical protein 0.0036 0.0294 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0181 0.0503
Echinococcus granulosus histone lysine methyltransferase setb 0.0018 0.0074 0.0216
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0327 0.399 1
Trichomonas vaginalis phosphatidylinositol-4-phosphate 5-kinase type II, putative 0.0015 0.0036 0.0042
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0018 0.0065 0.0122
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.0089 0.5711
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0323 0.0845
Brugia malayi MH2 domain containing protein 0.0139 0.1608 0.4435
Schistosoma mansoni ap endonuclease 0.0019 0.0089 0.0168
Schistosoma mansoni cpg binding protein 0.0028 0.0203 0.0488
Loa Loa (eye worm) FYVE zinc finger family protein 0.0015 0.0036 0.01
Echinococcus granulosus lamin 0.0027 0.0181 0.056
Echinococcus granulosus chromobox protein 1 0.0068 0.07 0.222
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0099 0.1094 0.1088
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0018 0.0066 0.006
Leishmania major DNA polymerase eta, putative 0.0023 0.0129 0.0234
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0089 0.0189
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0159 1
Schistosoma mansoni tar DNA-binding protein 0.026 0.3129 0.869
Loa Loa (eye worm) hypothetical protein 0.0046 0.0421 0.117
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0089 0.0265
Loa Loa (eye worm) MH2 domain-containing protein 0.0139 0.1608 0.4472
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0159 1
Schistosoma mansoni zinc finger protein 0.0022 0.0119 0.0254
Echinococcus granulosus survival motor neuron protein 1 0.0234 0.2805 0.8962
Echinococcus granulosus phosphatidylinositol phosphate 5 kinase type III 0.0015 0.0036 0.0096
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.0129 0.0113
Echinococcus multilocularis lamin dm0 0.0027 0.0181 0.0175
Loa Loa (eye worm) hypothetical protein 0.018 0.2127 0.5915
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0046 0.0426 0.0987
Echinococcus granulosus dna polymerase kappa 0.0023 0.0129 0.0392
Mycobacterium ulcerans hypothetical protein 0.0173 0.2027 0.5527
Loa Loa (eye worm) latrophilin receptor protein 2 0.008 0.0851 0.2366
Schistosoma mansoni hypothetical protein 0.008 0.0851 0.2305
Schistosoma mansoni mixed-lineage leukemia protein mll 0.006 0.0606 0.1618
Onchocerca volvulus 0.019 0.2246 1
Loa Loa (eye worm) bromodomain containing protein 0.0018 0.0074 0.0205
Trypanosoma cruzi ISWI complex protein 0.0016 0.0043 0.0017
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Schistosoma mansoni phosphatidylinositol-4-phosphate-5-kinaseputativ e 0.0015 0.0036 0.002
Loa Loa (eye worm) hypothetical protein 0.003 0.022 0.061
Loa Loa (eye worm) hypothetical protein 0.0023 0.0129 0.0357
Schistosoma mansoni tar DNA-binding protein 0.026 0.3129 0.869
Schistosoma mansoni hypothetical protein 0.008 0.0851 0.2305
Brugia malayi Bromodomain containing protein 0.0079 0.0843 0.2293
Trypanosoma cruzi ISWI complex protein 0.0016 0.0043 0.0017
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.008 0.0851 0.0845
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.008 0.0851 0.2315
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0159 1
Onchocerca volvulus 0.0028 0.0203 0.0106
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0099 0.1094 0.3482
Echinococcus multilocularis phosphatidylinositol 5 phosphate 4 kinase type 2 0.019 0.2246 0.2242
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0089 0.0134
Loa Loa (eye worm) hypothetical protein 0.0013 0.0006 0.0017
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0023 0.0129 0.0205
Echinococcus granulosus methyl CpG binding domain protein 2 0.0018 0.0066 0.0191
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0019 0.0089 0.2048
Loa Loa (eye worm) hypothetical protein 0.0018 0.0074 0.0205
Brugia malayi chromobox protein homolog 3 0.0038 0.0323 0.0837
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0089 0.0083
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0037 0.0312 0.0306
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0155 0.1806 0.4476
Echinococcus multilocularis tar DNA binding protein 0.026 0.3129 0.3125
Echinococcus granulosus muscleblind protein 0.018 0.2127 0.6792
Schistosoma mansoni phosphatidylinositol-4-phosphate 5-kinase type II 0.0015 0.0036 0.002
Schistosoma mansoni bromodomain containing protein 0.0067 0.069 0.1854
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0203 0.0564
Trypanosoma cruzi DNA polymerase eta, putative 0.0023 0.0129 0.0234
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0294 0.0743
Loa Loa (eye worm) hypothetical protein 0.019 0.2246 0.6246
Schistosoma mansoni hypothetical protein 0.0016 0.0043 0.004
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0018 0.0065 0.0122
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0183 0.0453
Trichomonas vaginalis glutaminase, putative 0.0296 0.3597 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0175 0.0486
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0066 0.0104
Leishmania major hypothetical protein, conserved 0.0016 0.0043 0.0017
Schistosoma mansoni phosphatidylinositol-4-phosphate 5-kinase type II 0.0015 0.0036 0.002
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0018 0.0065 0.0122
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0089 0.0134
Loa Loa (eye worm) glutaminase 0.0296 0.3597 1
Brugia malayi Heterochromatin protein 1 0.0068 0.07 0.1891
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0129 0.0292
Echinococcus multilocularis survival motor neuron protein 1 0.0234 0.2805 0.2801
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0046 0.0426 0.0987
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0099 0.1094 0.3482
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0018 0.0074 0.0126
Brugia malayi Pip kinase protein 1 0.0015 0.0036 0.0033
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0129 0.0234
Loa Loa (eye worm) transcription factor SMAD2 0.0139 0.1608 0.4472
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0023 0.0129 0.0234
Schistosoma mansoni chromobox protein 0.0068 0.07 0.188
Echinococcus multilocularis Phosphatidylinositol 4 phosphate 5 kinase type 1 0.0015 0.0036 0.003
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0089 0.0247
Schistosoma mansoni phosphatidylinositol-4-phosphate 5-kinase type II 0.019 0.2246 0.6216
Echinococcus granulosus tar DNA binding protein 0.026 0.3129 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0099 0.1094 0.3041
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0089 0.4298
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0015 0.0027 0.0017
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0025 0.0158 0.0362
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0048 0.0447 0.1185
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0066 0.0104
Echinococcus multilocularis muscleblind protein 0.018 0.2127 0.2122
Trichomonas vaginalis conserved hypothetical protein 0.0015 0.0027 0.0017
Schistosoma mansoni lamin 0.0027 0.0181 0.0426
Mycobacterium ulcerans glutaminase 0.0296 0.3597 1
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0129 0.0234
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.008 0.0851 0.2706
Schistosoma mansoni tar DNA-binding protein 0.026 0.3129 0.869
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Schistosoma mansoni phosphatidylinositol-4-phosphate 5-kinase type II 0.019 0.2246 0.6216
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.008 0.0851 0.0845
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Echinococcus granulosus GPCR family 2 0.008 0.0851 0.2706
Schistosoma mansoni zinc finger protein 0.0016 0.0043 0.004
Schistosoma mansoni hypothetical protein 0.0021 0.0113 0.0235
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0181 0.0503
Brugia malayi latrophilin 2 splice variant baaae 0.0172 0.2021 0.5589
Brugia malayi hypothetical protein 0.0016 0.0047 0.0064
Brugia malayi Bromodomain containing protein 0.004 0.0343 0.0894
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.026 0.3129 0.87
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.004 0.001
Loa Loa (eye worm) hypothetical protein 0.0073 0.0767 0.2132
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.008 0.0851 0.2706
Echinococcus multilocularis lamin 0.0027 0.0181 0.0175
Brugia malayi hypothetical protein 0.0234 0.2805 0.7784
Schistosoma mansoni phosphatidylinositol-4-phosphate 5-kinase type I 0.0015 0.0036 0.002
Trichomonas vaginalis chromobox protein, putative 0.0068 0.07 0.1898
Schistosoma mansoni cpg binding protein 0.0032 0.0248 0.0615
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.0089 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0099 0.1094 0.2985
Schistosoma mansoni hypothetical protein 0.0048 0.0447 0.1173
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0023 0.0129 0.0357
Loa Loa (eye worm) pip kinase 1 0.0015 0.0036 0.01
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.0129 0.0113
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.004 0.001
Schistosoma mansoni survival motor neuron protein 0.0048 0.0447 0.1173
Schistosoma mansoni hypothetical protein 0.0036 0.0294 0.0743
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0099 0.1094 0.2985
Trichomonas vaginalis chromobox protein, putative 0.0068 0.07 0.1898
Trypanosoma brucei ISWI complex protein 0.0016 0.0043 0.0017
Loa Loa (eye worm) RNA binding protein 0.026 0.3129 0.87
Schistosoma mansoni glutaminase 0.0296 0.3597 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.0375 0.1043
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0099 0.1094 0.2994
Mycobacterium tuberculosis Conserved hypothetical protein 0.0023 0.0129 0.0205
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0056 0.0554 0.1309
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0327 0.399 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0037 0.0312 0.0981
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0023 0.0129 0.0279
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0063 0.0643 0.0638
Entamoeba histolytica hypothetical protein 0.0036 0.0294 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Brugia malayi RNA recognition motif domain containing protein 0.026 0.3129 0.8692
Echinococcus granulosus Phosphatidylinositol 4 phosphate 5 kinase type 1 0.0015 0.0036 0.0096
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0046 0.0426 0.0987
Echinococcus multilocularis chromobox protein 1 0.0068 0.07 0.0694
Leishmania major mitochondrial DNA polymerase beta 0.0327 0.399 1
Toxoplasma gondii hypothetical protein 0.0053 0.0512 0.9161
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0023 0.0129 0.0392
Onchocerca volvulus 0.003 0.022 0.0187
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0089 0.4298
Echinococcus granulosus intermediate filament protein 0.0027 0.0181 0.056
Entamoeba histolytica deoxycytidyl transferase, putative 0.0023 0.0129 0.3587
Echinococcus granulosus dna polymerase eta 0.0023 0.0129 0.0392
Schistosoma mansoni DNA polymerase eta 0.0023 0.0129 0.0279
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Schistosoma mansoni intermediate filament proteins 0.0027 0.0181 0.0426
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0252 0.3029 0.8411
Loa Loa (eye worm) TAR-binding protein 0.026 0.3129 0.87
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0023 0.0129 0.03
Echinococcus granulosus fetal alzheimer antigen falz 0.0025 0.0158 0.0487
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0023 0.0129 0.0122
Brugia malayi hypothetical protein 0.0036 0.0294 0.0755
Loa Loa (eye worm) hypothetical protein 0.004 0.0344 0.0957
Brugia malayi RNA binding protein 0.026 0.3129 0.8692
Echinococcus multilocularis GPCR, family 2 0.008 0.0851 0.0845
Trypanosoma brucei DNA polymerase eta, putative 0.0023 0.0129 0.0234
Giardia lamblia DINP protein human, muc B family 0.0023 0.0129 1
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0089 0.0181
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0018 0.0065 0.0122
Trichomonas vaginalis DNA polymerase eta, putative 0.0023 0.0129 0.03
Brugia malayi glutaminase DH11.1 0.0296 0.3597 1
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0089 0.0189
Brugia malayi intermediate filament protein 0.0027 0.0181 0.0439
Loa Loa (eye worm) CHromoDomain protein family member 0.0015 0.0029 0.008
Loa Loa (eye worm) hypothetical protein 0.0025 0.0159 0.0442
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0099 0.1094 0.2985
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0038 0.0323 0.0689
Trichomonas vaginalis chromobox protein, putative 0.0041 0.036 0.0947
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0018 0.0074 0.0126
Trypanosoma brucei unspecified product 0.0016 0.004 0.001
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0181 0.0439
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0018 0.0065 0.0122
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0015 0.0029 0.0023
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Loa Loa (eye worm) hypothetical protein 0.0027 0.0181 0.0503
Toxoplasma gondii histone lysine methyltransferase SET1 0.0056 0.0556 1
Loa Loa (eye worm) hypothetical protein 0.0234 0.2805 0.7799
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0159 0.0311
Loa Loa (eye worm) hypothetical protein 0.0038 0.0323 0.0899
Leishmania major DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Loa Loa (eye worm) glutaminase 2 0.0296 0.3597 1
Loa Loa (eye worm) FYVE finger-containing phosphoinositide kinase 0.0015 0.0036 0.01
Mycobacterium tuberculosis Conserved hypothetical protein 0.0173 0.2027 1
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0089 0.5
Echinococcus granulosus chromobox protein 1 0.0068 0.07 0.222
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0089 0.0134
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0041 0.036 0.0865
Schistosoma mansoni cpg binding protein 0.0032 0.0248 0.0615
Trichomonas vaginalis chromobox protein, putative 0.0041 0.036 0.0947
Echinococcus multilocularis zinc finger protein 0.0022 0.0119 0.0113
Echinococcus granulosus zinc finger protein 0.0022 0.0119 0.0362
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0063 0.0643 0.2041
Loa Loa (eye worm) hypothetical protein 0.018 0.2127 0.5915
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0159 0.0311
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0018 0.0065 0.0122
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Toxoplasma gondii exonuclease III APE 0.0019 0.0089 0.1016
Loa Loa (eye worm) PHD-finger family protein 0.0021 0.0113 0.0313
Schistosoma mansoni chromobox protein 0.0068 0.07 0.188
Echinococcus granulosus cpg binding protein 0.0032 0.0248 0.0775
Echinococcus multilocularis muscleblind protein 1 0.018 0.2127 0.2122
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0155 0.1806 0.4476
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0252 0.3029 0.8421
Entamoeba histolytica hypothetical protein 0.0036 0.0294 1
Schistosoma mansoni hypothetical protein 0.008 0.0851 0.2305
Leishmania major hypothetical protein, conserved 0.0025 0.0159 0.0311
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0018 0.0065 0.0122
Loa Loa (eye worm) hypothetical protein 0.0252 0.3029 0.8421
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0018 0.0065 0.0122
Brugia malayi Latrophilin receptor protein 2 0.008 0.0851 0.2315
Brugia malayi CXXC zinc finger family protein 0.0028 0.0203 0.05
Onchocerca volvulus 0.0048 0.0447 0.129
Schistosoma mansoni tar DNA-binding protein 0.026 0.3129 0.869
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0183 0.0453
Trypanosoma brucei unspecified product 0.0016 0.004 0.001
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0159 0.0311
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0323 0.0845
Schistosoma mansoni terminal deoxycytidyl transferase 0.0023 0.0129 0.0279
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0099 0.1094 0.1088
Schistosoma mansoni lamin 0.0027 0.0181 0.0426
Brugia malayi TAR-binding protein 0.026 0.3129 0.8692
Echinococcus multilocularis dna polymerase eta 0.0023 0.0129 0.0122
Echinococcus multilocularis musashi 0.0027 0.0181 0.0175
Brugia malayi Pip kinase protein 2 0.019 0.2246 0.6221
Echinococcus multilocularis cpg binding protein 0.0032 0.0248 0.0242
Schistosoma mansoni hypothetical protein 0.008 0.0851 0.2305
Brugia malayi hypothetical protein 0.0025 0.0159 0.0377
Brugia malayi CHD4 protein 0.0015 0.0029 0.0013
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0129 0.0292
Loa Loa (eye worm) hypothetical protein 0.0172 0.2021 0.5619
Brugia malayi PHD-finger family protein 0.0027 0.0189 0.0462
Echinococcus multilocularis dna polymerase kappa 0.0023 0.0129 0.0122
Schistosoma mansoni ap endonuclease 0.0019 0.0089 0.0168
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0129 0.0234
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0025 0.0158 0.0152
Loa Loa (eye worm) hypothetical protein 0.008 0.0851 0.2366
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0327 0.399 1
Entamoeba histolytica hypothetical protein 0.0036 0.0294 1
Loa Loa (eye worm) pip kinase 2 0.019 0.2246 0.6246
Echinococcus granulosus lamin dm0 0.0027 0.0181 0.056
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0129 0.0234
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0015 0.0029 0.0072
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0014 0.0024 0.0067
Brugia malayi FYVE finger-containing phosphoinositide kinase, putative 0.0015 0.0036 0.0033
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0018 0.0074 0.0068
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.004 0.001
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0294 0.0288
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0046 0.0426 0.0987
Brugia malayi Muscleblind-like protein 0.018 0.2127 0.5887
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0294 0.0921
Schistosoma mansoni hypothetical protein 0.0172 0.2021 0.5583
Echinococcus multilocularis chromobox protein 1 0.0068 0.07 0.0694
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0155 0.1806 0.4476
Brugia malayi Calcitonin receptor-like protein seb-1 0.0252 0.3029 0.8411

Activities

Activity type Activity value Assay description Source Reference
Potency (binding) 2.8184 uM PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 7.3753 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 100 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) 100 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
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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