Detailed information for compound 342979

Basic information

Technical information
  • TDR Targets ID: 342979
  • Name: N'-hydroxy-N-[4-[(4-methylphenyl)methylamino] butyl]octanediamide; 2,2,2-trifluoroacetic ac id
  • MW: 477.518 | Formula: C22H34F3N3O5
  • H donors: 5 H acceptors: 5 LogP: 0.8 Rotable bonds: 17
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)C(F)(F)F.ONC(=O)CCCCCCC(=O)NCCCCNCc1ccc(cc1)C
  • InChi: 1S/C20H33N3O3.C2HF3O2/c1-17-10-12-18(13-11-17)16-21-14-6-7-15-22-19(24)8-4-2-3-5-9-20(25)23-26;3-2(4,5)1(6)7/h10-13,21,26H,2-9,14-16H2,1H3,(H,22,24)(H,23,25);(H,6,7)
  • InChiKey: LYSGQJXVHOTCNW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 8-(hydroxyamino)-8-oxo-N-[4-(p-tolylmethylamino)butyl]octanamide; 2,2,2-trifluoroacetic acid
  • N'-hydroxy-N-[4-[(4-methylphenyl)methylamino]butyl]octanediamide; 2,2,2-trifluoroethanoic acid
  • 8-(hydroxyamino)-8-keto-N-[4-[(4-methylbenzyl)amino]butyl]caprylamide; 2,2,2-trifluoroacetic acid

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
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
Trichomonas vaginalis glutaminase, putative 0.0287 0.0444 1
Echinococcus granulosus flap endonuclease 1 0.0027 0.0034 0.051
Loa Loa (eye worm) Smad1 0.0009 0.0004 0.0089
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0008 0.0115
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0022 0.0081
Schistosoma mansoni smad1 5 8 and 0.0009 0.0004 0.0066
Echinococcus granulosus Helicase SANT associated DNA binding 0.0006 0.0001 0.001
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.0008 0.0154
Loa Loa (eye worm) latrophilin receptor protein 2 0.0015 0.0015 0.03
Brugia malayi polk-prov protein 0.0006 0.0001 0.0001
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.0008 0.0011
Loa Loa (eye worm) glutaminase 0.0287 0.0444 0.886
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0015 0.0015 0.0225
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0003 0.0042
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.002 0.0023 0.0343
Loa Loa (eye worm) MH2 domain-containing protein 0.0009 0.0004 0.0089
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0038 0.0051 0.0756
Entamoeba histolytica exodeoxyribonuclease III, putative 0.002 0.0022 0.039
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.003 0.0669
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0006 0.0008
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.0003 0.0042
Leishmania major DNA polymerase eta, putative 0.0006 0.0001 0.0003
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.0008 0.0115
Plasmodium falciparum flap endonuclease 1 0.0027 0.0034 0.0125
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.0008 0.0115
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0017 0.0256
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.002 0.0023 0.0084
Schistosoma mansoni hypothetical protein 0.0341 0.0531 0.7932
Schistosoma mansoni helicase 0.007 0.0102 0.1529
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0009 0.0004 0.0066
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0022 0.0081
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0.0022 0.021
Trypanosoma brucei unspecified product 0.0014 0.0013 0.0048
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Echinococcus multilocularis Smad4 0.0009 0.0004 0.0066
Echinococcus granulosus dna polymerase eta 0.002 0.0023 0.0343
Loa Loa (eye worm) glutaminase 2 0.0287 0.0444 0.886
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0067 0.0092
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0008 0.0011
Loa Loa (eye worm) hypothetical protein 0.004 0.0055 0.1094
Echinococcus granulosus BRK domain containing protein 0.0012 0.001 0.0153
Schistosoma mansoni DNA polymerase IV / kappa 0.0006 0.0001 0.0013
Brugia malayi MH1 domain containing protein 0.0009 0.0004 0.0006
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0008 0.0115
Giardia lamblia DINP protein human, muc B family 0.002 0.0023 0.0081
Schistosoma mansoni hypothetical protein 0.0015 0.0015 0.0225
Echinococcus granulosus cpg binding protein 0.0067 0.0097 0.1447
Loa Loa (eye worm) isocitrate dehydrogenase 0.0017 0.0017 0.0342
Trichomonas vaginalis flap endonuclease-1, putative 0.0027 0.0034 0.0768
Brugia malayi MH1 domain containing protein 0.0009 0.0004 0.0006
Echinococcus granulosus geminin 0.0341 0.0531 0.7932
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0317 0.0492 0.1803
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.002 0.0023 0.0244
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0017 0.0017 0.006
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0023 0.0081
Trypanosoma brucei cytosine-specific DNA methylase, putative 0.0021 0.0024 0.0087
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0.0008 0.0115
Plasmodium falciparum DNA repair protein REV1, putative 0.0006 0.0001 0.0003
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.0008 0.0115
Trypanosoma brucei telomerase reverse transcriptase 0.1728 0.2725 1
Trypanosoma brucei DNA damage repair protein, putative 0.0006 0.0001 0.0003
Echinococcus multilocularis DNA methyltransferase 2, putative 0.0021 0.0024 0.0354
Brugia malayi Associated with TFs and helicases family protein 0.0012 0.001 0.0014
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.1728 0.2725 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Brugia malayi Importin beta-1 subunit 0.003 0.0039 0.0053
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0323 0.0502 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.0008 0.0115
Loa Loa (eye worm) hypothetical protein 0.0157 0.0239 0.476
Brugia malayi MH2 domain containing protein 0.0125 0.0189 0.026
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0154
Entamoeba histolytica hypothetical protein 0.0038 0.0051 0.0892
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0317 0.0492 0.1805
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.0008 0.0115
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0027 0.0034 0.0125
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.002 0.0023 0.0517
Mycobacterium tuberculosis Conserved hypothetical protein 0.002 0.0023 0.0244
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0023 0.0032
Loa Loa (eye worm) CXXC zinc finger family protein 0.0065 0.0094 0.1878
Schistosoma mansoni hypothetical protein 0.0038 0.0051 0.0756
Onchocerca volvulus Bile acid receptor homolog 0.0011 0.0008 0.0007
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.0008 0.0011
Loa Loa (eye worm) transcription factor SMAD2 0.0125 0.0189 0.3768
Echinococcus granulosus FTZ F1 alpha 0.0011 0.0008 0.0115
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0027 0.0034 0.0125
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.0008 0.0115
Echinococcus multilocularis disco interacting protein 2 0.004 0.0055 0.0819
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.002 0.0023 0.0343
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.0008 0.0154
Brugia malayi Disco-interacting protein 2 homolog 0.004 0.0055 0.0075
Echinococcus multilocularis BRK domain 0.0012 0.001 0.0153
Plasmodium falciparum importin beta, putative 0.003 0.0039 0.0142
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.0008 0.0154
Brugia malayi Smad1 0.0009 0.0004 0.0006
Echinococcus multilocularis muscleblind protein 0.0157 0.0239 0.3566
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.0008 0.0115
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0023 0.0084
Mycobacterium ulcerans DNA polymerase IV 0.002 0.0023 0.0498
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0023 0.0084
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0023 0.0081
Plasmodium vivax flap endonuclease 1, putative 0.0027 0.0034 0.0125
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0154
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0022 0.0331
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0022 0.0081
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.0008 0.0115
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0023 0.0032
Leishmania major DNA polymerase eta, putative 0.002 0.0023 0.0084
Echinococcus granulosus Chromo domain 0.0012 0.001 0.0153
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Plasmodium falciparum Snf2-related CBP activator, putative 0.0006 0.0001 0.0002
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0023 0.0084
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0022 0.003
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.0008 0.0115
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0006 0.0001 0.0003
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0061 0.0909
Echinococcus multilocularis flap endonuclease 1 0.0027 0.0034 0.051
Toxoplasma gondii isocitrate dehydrogenase 0.0017 0.0017 0.0063
Leishmania major importin beta-1 subunit, putative 0.0025 0.003 0.0109
Leishmania major modification methylase-like protein 0.0021 0.0024 0.0087
Entamoeba histolytica DNA repair and recombination protein RAD52, putative 0.0365 0.0568 1
Schistosoma mansoni smad 0.0009 0.0004 0.0066
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.015 0.0228 0.0837
Echinococcus granulosus importin subunit beta 1 0.003 0.0039 0.0579
Brugia malayi RNA, U transporter 1 0.0086 0.0127 0.0175
Trypanosoma brucei chrX additional, unordered contigs 0.0006 0.0001 0.0003
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Echinococcus multilocularis dnaJ subfamily B 0.0429 0.0669 1
Onchocerca volvulus 0.004 0.0055 0.0054
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.0013 0.0048
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0317 0.0492 0.1803
Brugia malayi Flap endonuclease-1 0.0027 0.0034 0.0047
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.0008 0.0115
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0023 0.0084
Echinococcus multilocularis Chromo domain 0.0012 0.001 0.0153
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0006 0.0113
Brugia malayi isocitrate dehydrogenase 0.0017 0.0017 0.0024
Echinococcus multilocularis smad 0.0009 0.0004 0.0066
Echinococcus granulosus smad 0.0009 0.0004 0.0066
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.0008 0.0011
Leishmania major mitochondrial DNA polymerase beta 0.0317 0.0492 0.1805
Echinococcus granulosus helicase 0.0006 0.0001 0.001
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.0008 0.0115
Echinococcus granulosus polybromo 1 0.0007 0.0001 0.0019
Toxoplasma gondii DNA methyltransferase 2, putative 0.0021 0.0024 0.0087
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Schistosoma mansoni ap endonuclease 0.002 0.0022 0.0331
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Brugia malayi polybromodomain protein 0.0007 0.0001 0.0002
Plasmodium vivax helicase, putative 0.0006 0.0001 0.0002
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0054 0.0077 0.0279
Schistosoma mansoni ap endonuclease 0.002 0.0022 0.0331
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0061 0.0909
Echinococcus multilocularis helicase 0.0006 0.0001 0.001
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0006 0.0085
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0006 0.0085
Brugia malayi nuclear receptor NHR-88 0.0011 0.0008 0.0011
Toxoplasma gondii SWI2/SNF2 Brahma-like putative 0.0013 0.0011 0.0041
Mycobacterium ulcerans hypothetical protein 0.0167 0.0255 0.5726
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0008 0.0115
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0009 0.0004 0.0066
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0006 0.0001 0.0003
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.0008 0.0011
Giardia lamblia Telomerase catalytic subunit 0.1728 0.2725 1
Echinococcus granulosus mothers against decapentaplegic 5 0.0009 0.0004 0.0066
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.0008 0.0011
Loa Loa (eye worm) BRM protein 0.0036 0.0049 0.0968
Trypanosoma brucei DNA polymerase kappa, putative 0.0006 0.0001 0.0003
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0006 0.0001 0.0003
Trypanosoma brucei DNA polymerase eta, putative 0.002 0.0023 0.0084
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.0008 0.0011
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0008 0.0011
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.015 0.0228 0.0834
Schistosoma mansoni DNA (cytosine-5)-methyltransferase 0.0021 0.0024 0.0354
Loa Loa (eye worm) hypothetical protein 0.0048 0.0067 0.1338
Trypanosoma brucei DNA damage repair protein, putative 0.0006 0.0001 0.0003
Schistosoma mansoni hypothetical protein 0.0006 0.0001 0.001
Plasmodium vivax importin-beta 2, putative 0.003 0.0039 0.0142
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0022 0.0442
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0008 0.0011
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Toxoplasma gondii HEAT repeat-containing protein 0.003 0.0039 0.0142
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.0008 0.0154
Schistosoma mansoni DNA polymerase eta 0.002 0.0023 0.0343
Echinococcus multilocularis BRK domain containing protein 0.0012 0.001 0.0153
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.0008 0.0115
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0008 0.0115
Entamoeba histolytica Rad52/22 family double-strand break repair protein, putative 0.0104 0.0155 0.2731
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0008 0.0115
Trypanosoma brucei hypothetical protein, conserved 0.0006 0.0001 0.0003
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0154
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.0008 0.0115
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.002 0.0023 0.0458
Echinococcus multilocularis BRK domain containing protein 0.0012 0.001 0.0153
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Trichomonas vaginalis lymphoid specific helicase, putative 0.0013 0.0011 0.0253
Schistosoma mansoni helicase 0.0006 0.0001 0.001
Trypanosoma cruzi DNA polymerase eta, putative 0.002 0.0023 0.0081
Schistosoma mansoni smad1 5 8 and 0.0009 0.0004 0.0066
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.0008 0.0115
Trypanosoma brucei unspecified product 0.0014 0.0013 0.0048
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0067 0.1338
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0017 0.0256
Brugia malayi MH2 domain containing protein 0.0009 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0154
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0022 0.0498
Schistosoma mansoni glutaminase 0.0287 0.0444 0.6638
Schistosoma mansoni nuclear hormone receptor 0.0011 0.0008 0.0115
Onchocerca volvulus 0.0011 0.0008 0.0007
Loa Loa (eye worm) hypothetical protein 0.0006 0.0001 0.0021
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.0008 0.0154
Loa Loa (eye worm) hypothetical protein 0.0007 0.0001 0.0025
Loa Loa (eye worm) flap endonuclease-1 0.0027 0.0034 0.0681
Entamoeba histolytica Flap nuclease, putative 0.0027 0.0034 0.0602
Schistosoma mansoni Smad4 0.0009 0.0004 0.0066
Echinococcus multilocularis isocitrate dehydrogenase 0.0017 0.0017 0.0256
Brugia malayi hypothetical protein 0.0038 0.0051 0.007
Loa Loa (eye worm) hypothetical protein 0.0015 0.0015 0.03
Loa Loa (eye worm) MH1 domain-containing protein 0.0009 0.0004 0.0089
Echinococcus multilocularis GPCR, family 2 0.0015 0.0015 0.0225
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0061 0.0909
Schistosoma mansoni transcription factor LCR-F1 0.0038 0.0051 0.0756
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0045 0.0061 0.0222
Loa Loa (eye worm) MH2 domain-containing protein 0.0125 0.0189 0.3768
Entamoeba histolytica deoxycytidyl transferase, putative 0.002 0.0023 0.0405
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0064 0.0092 0.1374
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0154
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0043 0.0059
Loa Loa (eye worm) BRM protein 0.0045 0.0062 0.1238
Echinococcus multilocularis dna polymerase kappa 0.002 0.0023 0.0343
Schistosoma mansoni disco-interacting protein 2 (dip2) 0.004 0.0055 0.0819
Echinococcus multilocularis muscleblind protein 1 0.0157 0.0239 0.3566
Echinococcus multilocularis BRK domain containing protein 0.0012 0.001 0.0153
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0022 0.0498
Echinococcus granulosus muscleblind protein 0.0157 0.0239 0.3566
Brugia malayi BRM protein 0.007 0.0102 0.0141
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0.0008 0.0007
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0017 0.0017 0.0063
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0017 0.0017 0.0256
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0008 0.0011
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0038 0.0051 0.0756
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0022 0.0078
Loa Loa (eye worm) hypothetical protein 0.002 0.0023 0.0458
Echinococcus granulosus Smad4 0.0009 0.0004 0.0066
Schistosoma mansoni importin beta-1 0.003 0.0039 0.0579
Toxoplasma gondii hypothetical protein 0.0051 0.0072 0.0263
Echinococcus multilocularis global transcription activator snf2l2 0.007 0.0102 0.1529
Giardia lamblia DNA repair protein RAD52 0.0365 0.0568 0.2081
Mycobacterium tuberculosis Conserved hypothetical protein 0.0167 0.0255 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0022 0.0331
Leishmania major DNA damage repair protein, putative 0.0006 0.0001 0.0003
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0017 0.0256
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0027 0.0034 0.0122
Trypanosoma cruzi importin beta-1 subunit, putative 0.0025 0.003 0.0106
Plasmodium falciparum DEAD/DEAH box helicase, putative 0.0011 0.0008 0.003
Schistosoma mansoni hypothetical protein 0.0012 0.001 0.0153
Echinococcus multilocularis dna polymerase eta 0.002 0.0023 0.0343
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.0003 0.0042
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Loa Loa (eye worm) hypothetical protein 0.003 0.0039 0.0773
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.015 0.0228 0.0837
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0023 0.0084
Echinococcus multilocularis Helicase SANT associated, DNA binding 0.0006 0.0001 0.001
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0023 0.0084
Schistosoma mansoni hypothetical protein 0.0015 0.0015 0.0225
Toxoplasma gondii SWI2/SNF2 Brahma-like putative 0.0011 0.0008 0.003
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.0003 0.0042
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.1728 0.2725 1
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.0008 0.0115
Brugia malayi Isocitrate dehydrogenase 0.0017 0.0017 0.0024
Brugia malayi Telomerase reverse transcriptase 0.4599 0.7266 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.0061 0.1213
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0045 0.0061 0.0222
Echinococcus granulosus DNA methyltransferase 2, putative 0.0021 0.0024 0.0354
Loa Loa (eye worm) helicase DNA-binding protein 0.0012 0.001 0.0204
Brugia malayi nuclear hormone receptor 0.0011 0.0008 0.0011
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.0008 0.0115
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.0013 0.0048
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.0003 0.0042
Leishmania major DNA polymerase kappa, putative 0.002 0.0023 0.0084
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0023 0.0084
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.003 0.0669
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0.0022 0.0479
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0154
Loa Loa (eye worm) SNF2 family domain-containing protein 0.0006 0.0001 0.0013
Plasmodium vivax DNA repair protein REV1, putative 0.0006 0.0001 0.0003
Leishmania major DNA polymerase kappa, putative 0.0006 0.0001 0.0003
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0027 0.0034 0.0125
Schistosoma mansoni hypothetical protein 0.0323 0.0502 0.7492
Echinococcus granulosus dna polymerase kappa 0.002 0.0023 0.0343
Plasmodium falciparum DNA (cytosine-5)-methyltransferase 0.0021 0.0024 0.0087
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.002 0.0023 0.0343
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0017 0.0017 0.0063
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.0061 0.0084
Plasmodium vivax hypothetical protein, conserved 0.0006 0.0001 0.0002
Schistosoma mansoni cpg binding protein 0.0067 0.0097 0.1447
Schistosoma mansoni terminal deoxycytidyl transferase 0.002 0.0023 0.0343
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.0008 0.0115
Brugia malayi glutaminase DH11.1 0.0287 0.0444 0.0612
Schistosoma mansoni coup transcription factor 0.0011 0.0008 0.0115
Trypanosoma brucei unspecified product 0.002 0.0023 0.0084
Toxoplasma gondii hypothetical protein 0.0089 0.0131 0.0482
Echinococcus multilocularis BRK domain containing protein 0.0012 0.001 0.0153
Echinococcus granulosus snurportin 1 0.0323 0.0502 0.7492
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0017 0.0063
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0061 0.0909
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.0008 0.0115
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0023 0.0081
Echinococcus granulosus dnaJ subfamily B 0.0429 0.0669 1
Echinococcus granulosus disco interacting protein 2 0.004 0.0055 0.0819
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.0008 0.0011
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0015 0.0015 0.0225
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0067 0.0092
Schistosoma mansoni hypothetical protein 0.0015 0.0015 0.0225
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0017 0.0017 0.0256
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.002 0.0022 0.0078
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0039 0.0142
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0008 0.0115
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0002 0.0039
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0017 0.0017 0.0063
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0045 0.0061 0.0222
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.0008 0.0154
Echinococcus multilocularis importin subunit beta 1 0.003 0.0039 0.0579
Echinococcus multilocularis polybromo 1 0.0007 0.0001 0.0019
Schistosoma mansoni flap endonuclease-1 0.0025 0.003 0.0448
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.0008 0.0154
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0154
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0023 0.0084
Echinococcus multilocularis BRK domain containing protein 0.0012 0.001 0.0153
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0039 0.0142
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0017 0.0063
Echinococcus multilocularis geminin 0.0341 0.0531 0.7932
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0022 0.0078
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0002 0.0039
Trichomonas vaginalis importin beta-1, putative 0.0025 0.003 0.0669
Brugia malayi CXXC zinc finger family protein 0.0065 0.0094 0.013
Leishmania major telomerase reverse transcriptase, putative 0.1728 0.2725 1
Brugia malayi SNF2 family N-terminal domain containing protein 0.0006 0.0001 0.0001
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.0008 0.0115
Brugia malayi Muscleblind-like protein 0.0157 0.0239 0.0329
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0154
Loa Loa (eye worm) hypothetical protein 0.0157 0.0239 0.476
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0022 0.5
Loa Loa (eye worm) hypothetical protein 0.0033 0.0043 0.0858
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0061 0.0909
Entamoeba histolytica hypothetical protein 0.0038 0.0051 0.0892
Schistosoma mansoni smad1 5 8 and 0.0009 0.0004 0.0066
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0022 0.5
Schistosoma mansoni cpg binding protein 0.0065 0.0094 0.1407
Echinococcus multilocularis chromodomain helicase DNA binding protein 7 0.0012 0.001 0.0153
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0015 0.0015 0.0225
Entamoeba histolytica hypothetical protein 0.0104 0.0155 0.2731
Schistosoma mansoni hypothetical protein 0.0014 0.0013 0.0193
Plasmodium vivax DNA (cytosine-5)-methyltransferase, putative 0.0021 0.0024 0.0087
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Onchocerca volvulus 0.0065 0.0094 0.0094
Echinococcus multilocularis snurportin 1 0.0323 0.0502 0.7492
Brugia malayi Latrophilin receptor protein 2 0.0015 0.0015 0.0021
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0.0008 0.0007
Giardia lamblia Flap structure-specific endonuclease 0.0027 0.0034 0.0122
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0008 0.0011
Echinococcus granulosus GPCR family 2 0.0015 0.0015 0.0225
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0023 0.0084
Plasmodium falciparum telomerase reverse transcriptase 0.1728 0.2725 1
Echinococcus multilocularis cpg binding protein 0.0067 0.0097 0.1447
Entamoeba histolytica hypothetical protein 0.0025 0.003 0.0524
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0023 0.0084
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0008 0.0115
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0023 0.0081
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0008 0.0011
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.0008 0.0011
Plasmodium vivax DEAD/DEAH helicase, putative 0.0011 0.0008 0.003
Toxoplasma gondii RNA-directed DNA polymerase 0.1728 0.2725 1
Entamoeba histolytica DNA (cytosine-5)-methyltransferase, putative 0.0021 0.0024 0.0418
Entamoeba histolytica hypothetical protein 0.0038 0.0051 0.0892
Loa Loa (eye worm) hypothetical protein 0.0006 0.0001 0.0018
Schistosoma mansoni hypothetical protein 0.0429 0.0669 1
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0023 0.0084
Toxoplasma gondii isocitrate dehydrogenase 0.0017 0.0017 0.0063
Brugia malayi SET domain containing protein 0.0007 0.0002 0.0003
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0015 0.0015 0.0225
Trichomonas vaginalis DNA polymerase eta, putative 0.002 0.0023 0.0517
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0008 0.0011
Mycobacterium ulcerans DNA polymerase IV 0.002 0.0023 0.0498
Brugia malayi MH2 domain containing protein 0.0009 0.0004 0.0006
Schistosoma mansoni cpg binding protein 0.0067 0.0097 0.1447
Schistosoma mansoni hypothetical protein 0.0015 0.0015 0.0225
Schistosoma mansoni hypothetical protein 0.0341 0.0531 0.7932
Toxoplasma gondii exonuclease III APE 0.002 0.0022 0.0081
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0017 0.006
Trypanosoma brucei hypothetical protein, conserved 0.0006 0.0001 0.0003
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0023 0.0084
Toxoplasma gondii C-5 cytosine-specific DNA methylase superfamily protein 0.0021 0.0024 0.0087
Trichomonas vaginalis helicase, putative 0.0007 0.0002 0.0039
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0015 0.0015 0.0021
Echinococcus multilocularis BRK domain containing protein 0.0012 0.001 0.0153
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.0008 0.0115
Toxoplasma gondii histone lysine methyltransferase SET1 0.0059 0.0084 0.0309
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0022 0.0081
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0089 0.0131 0.0482
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0061 0.0909
Schistosoma mansoni helicase 0.0006 0.0001 0.001
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.0013 0.0048
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0045 0.0061 0.0225
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0017 0.0017 0.0256
Entamoeba histolytica hypothetical protein 0.0038 0.0051 0.0892
Brugia malayi steroid hormone receptor 0.0011 0.0008 0.0011
Echinococcus multilocularis mothers against decapentaplegic 5 0.0009 0.0004 0.0066
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0023 0.0084
Mycobacterium ulcerans glutaminase 0.0287 0.0444 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0006 0.0001 0.0003
Plasmodium vivax telomerase reverse transcriptase, putative 0.1728 0.2725 1
Echinococcus granulosus TGF beta signal transducer SmadC 0.0009 0.0004 0.0066
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.0008 0.0154
Schistosoma mansoni hypothetical protein 0.0033 0.0043 0.0643
Schistosoma mansoni polybromo-1 0.0007 0.0001 0.0019
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0061 0.0909
Brugia malayi ecdysteroid receptor 0.0011 0.0008 0.0011
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.0008 0.0011
Echinococcus granulosus global transcription activator snf2l2 0.007 0.0102 0.1529

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 46.8 uM In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration ChEMBL. 16190761
IC50 (binding) = 46.8 uM In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration ChEMBL. 16190761

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.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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