Detailed information for compound 1572575

Basic information

Technical information
  • TDR Targets ID: 1572575
  • Name: (3S,5R,6R)-1,1-dimethoxy-6-(phenylmethoxy)hep tane-3,5-diol
  • MW: 298.375 | Formula: C16H26O5
  • H donors: 2 H acceptors: 2 LogP: 1.35 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(C[C@H](C[C@H]([C@H](OCc1ccccc1)C)O)O)OC
  • InChi: 1S/C16H26O5/c1-12(21-11-13-7-5-4-6-8-13)15(18)9-14(17)10-16(19-2)20-3/h4-8,12,14-18H,9-11H2,1-3H3/t12-,14+,15-/m1/s1
  • InChiKey: WFBQEQDZCXOJBE-VHDGCEQUSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (3S,5R,6R)-6-(benzyloxy)-1,1-dimethoxy-heptane-3,5-diol

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
Brugia malayi beta-lactamase family protein 0.0038 0.0341 0.0335
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0033 0.0278 0.0752
Trichomonas vaginalis chromobox protein, putative 0.0049 0.0485 0.0487
Echinococcus multilocularis dna polymerase eta 0.0023 0.0152 0.0152
Echinococcus multilocularis chromobox protein 1 0.0081 0.0903 0.0903
Brugia malayi beta-lactamase family protein 0.0038 0.0341 0.0335
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0144 0.0128
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0033 0.0278 0.8034
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0152 0.032
Loa Loa (eye worm) CXXC zinc finger family protein 0.0033 0.0284 0.0275
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0081 0.0895 0.0939
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0308 0.3837 0.4011
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.0144 0.0151
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0308 0.3837 0.4011
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0184 0.0431
Trichomonas vaginalis conserved hypothetical protein 0.0017 0.0075 0.0055
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0081 0.0895 0.0917
Echinococcus granulosus dnaJ subfamily B 0.0477 0.6031 0.6327
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0152 0.032
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0256 0.3167 0.3307
Schistosoma mansoni tar DNA-binding protein 0.0068 0.0725 0.0761
Loa Loa (eye worm) PHD-finger family protein 0.0045 0.0438 0.0437
Loa Loa (eye worm) hypothetical protein 0.0038 0.0341 0.0335
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0079 0.0874 0.0917
Onchocerca volvulus 0.0038 0.0341 0.0335
Echinococcus multilocularis dna polymerase kappa 0.0023 0.0152 0.0152
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.0341 0.0966
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.0341 0.1191
Plasmodium vivax hypothetical protein, conserved 0.0038 0.0341 1
Trichomonas vaginalis chromobox protein, putative 0.0049 0.0485 0.0487
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0121 0.0103
Brugia malayi CHD4 protein 0.0019 0.0101 0.0083
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0152 0.0071
Brugia malayi hypothetical protein 0.0026 0.0184 0.0171
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.0341 0.0335
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.016 0.0145
Schistosoma mansoni zinc finger protein 0.0045 0.0433 0.0454
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0152 0.0071
Loa Loa (eye worm) hypothetical protein 0.0038 0.0341 0.0335
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0121 0.0103
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0081 0.09 0.09
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0019 0.0101 0.0106
Loa Loa (eye worm) hypothetical protein 0.0038 0.0341 0.0335
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0022 0.0132 0.0115
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0152 0.0071
Leishmania major importin beta-1 subunit, putative 0.0024 0.016 0.01
Brugia malayi latrophilin 2 splice variant baaae 0.0175 0.2118 0.2203
Onchocerca volvulus 0.0014 0.0032 0.001
Schistosoma mansoni methyl-cpg binding protein mbd 0.0038 0.0336 0.0353
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0144 0.0128
Mycobacterium tuberculosis Conserved hypothetical protein 0.0023 0.0152 0.0027
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0017 0.0075 0.0055
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.0341 0.0692
Onchocerca volvulus Dual specificity protein kinase TTK homolog 0.0747 0.9532 1
Echinococcus granulosus chromobox protein 1 0.0081 0.0903 0.0947
Trypanosoma cruzi DNA polymerase eta, putative 0.0023 0.0152 0.0071
Schistosoma mansoni hypothetical protein 0.0034 0.0286 0.03
Brugia malayi RNA, U transporter 1 0.0084 0.0938 0.0963
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0308 0.3837 1
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.0152 0.0047
Echinococcus granulosus tumor protein p63 0.0332 0.4153 0.4356
Echinococcus granulosus chromodomain helicase DNA binding protein 1 0.0013 0.0022 0.0023
Echinococcus granulosus dna polymerase eta 0.0023 0.0152 0.0159
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0152 0.032
Trichomonas vaginalis ran, putative 0.0022 0.0132 0.0115
Schistosoma mansoni hypothetical protein 0.0692 0.8814 0.9247
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0019 0.0101 0.0101
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0023 0.0152 0.0136
Schistosoma mansoni tar DNA-binding protein 0.0068 0.0725 0.0761
Schistosoma mansoni chromobox protein 0.0013 0.0022 0.0023
Trichomonas vaginalis esterase, putative 0.0038 0.0341 0.0335
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0152 0.032
Leishmania major DNA polymerase kappa, putative 0.0023 0.0152 0.0071
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0152 0.032
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0184 0.6332
Loa Loa (eye worm) hypothetical protein 0.0122 0.143 0.148
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0242 0.2987 1
Leishmania major hypothetical protein, conserved 0.0075 0.0828 0.2438
Loa Loa (eye worm) TAR-binding protein 0.0068 0.0725 0.0739
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0081 0.0895 0.0895
Loa Loa (eye worm) heterochromatin protein 1 0.0081 0.0903 0.0926
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0308 0.3837 0.4011
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0341 0.0335
Trichomonas vaginalis CAMK family protein kinase 0.0747 0.9532 1
Schistosoma mansoni tar DNA-binding protein 0.0068 0.0725 0.0761
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0022 0.0132 0.3428
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0341 0.0734
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0152 0.032
Echinococcus multilocularis serotonin receptor 0.0122 0.143 0.143
Toxoplasma gondii isocitrate dehydrogenase 0.0033 0.0278 0.357
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.0341 0.0692
Schistosoma mansoni hypothetical protein 0.0075 0.0828 0.0868
Schistosoma mansoni smad1 5 8 and 0.0017 0.0065 0.0068
Brugia malayi MH2 domain containing protein 0.0017 0.0065 0.0044
Echinococcus multilocularis serotonin receptor 0.0122 0.143 0.143
Schistosoma mansoni bromodomain containing protein 0.0141 0.1678 0.1761
Mycobacterium tuberculosis Probable phytoene synthase PhyA 0.0075 0.0828 0.2404
Brugia malayi F/Y-rich N-terminus family protein 0.0014 0.0037 0.0015
Echinococcus multilocularis microtubule associated protein 2 0.0726 0.9262 0.9262
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.0341 0.0692
Giardia lamblia DINP protein human, muc B family 0.0023 0.0152 0.0022
Loa Loa (eye worm) RNA binding protein 0.0068 0.0725 0.0739
Brugia malayi Protein kinase domain containing protein 0.0747 0.9532 1
Schistosoma mansoni hypothetical protein 0.0081 0.09 0.0944
Echinococcus multilocularis Squalene phytoene synthase 0.0075 0.0828 0.0828
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0081 0.09 0.0944
Schistosoma mansoni chromobox protein 0.0013 0.0022 0.0023
Echinococcus granulosus histone lysine methyltransferase setb 0.0038 0.0345 0.0362
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0049 0.0485 0.0487
Schistosoma mansoni chromobox protein 0.0081 0.0903 0.0947
Schistosoma mansoni Smad4 0.0017 0.0065 0.0068
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0033 0.0278 0.0514
Brugia malayi Smad1 0.0017 0.0065 0.0044
Brugia malayi Bromodomain containing protein 0.0084 0.0942 0.0967
Schistosoma mansoni tar DNA-binding protein 0.0068 0.0725 0.0761
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0144 0.3825
Leishmania major hypothetical protein, conserved 0.0034 0.0286 0.0541
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0023 0.0152 0.0136
Echinococcus granulosus snurportin 1 0.0315 0.3935 0.4128
Echinococcus granulosus importin subunit beta 1 0.003 0.0233 0.0244
Leishmania major squalene synthase, putative 0.0242 0.2987 1
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0144 0.0128
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0051 0.0517 0.0517
Trypanosoma cruzi ISWI complex protein 0.0034 0.0286 0.0541
Loa Loa (eye worm) hypothetical protein 0.0075 0.0828 0.0847
Loa Loa (eye worm) isocitrate dehydrogenase 0.0033 0.0278 0.0269
Schistosoma mansoni biogenic amine (5HT) receptor 0.0122 0.143 0.15
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0068 0.0725 0.0739
Schistosoma mansoni smad1 5 8 and 0.0017 0.0065 0.0068
Mycobacterium tuberculosis Conserved protein 0.0038 0.0341 0.0692
Echinococcus multilocularis importin subunit beta 1 0.003 0.0233 0.0233
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0014 0.0032 0.0033
Brugia malayi isocitrate dehydrogenase 0.0033 0.0278 0.0269
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0038 0.0345 0.0345
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.016 0.0145
Schistosoma mansoni dual specificity serine/threonine tyrosine kinase 0.0747 0.9532 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0069 0.074 1
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0268 0.0258
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0081 0.0895 0.0939
Schistosoma mansoni hypothetical protein 0.0081 0.09 0.0944
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0144 0.5
Schistosoma mansoni ap endonuclease 0.0023 0.0144 0.0151
Echinococcus granulosus dna polymerase kappa 0.0023 0.0152 0.0159
Echinococcus granulosus TGF beta signal transducer SmadC 0.0017 0.0065 0.0068
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0081 0.09 0.09
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0033 0.0278 0.0752
Echinococcus multilocularis Chromobox protein 3 0.0013 0.0022 0.0022
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0081 0.0895 0.0917
Echinococcus multilocularis tumor protein p63 0.0332 0.4153 0.4153
Loa Loa (eye worm) latrophilin receptor protein 2 0.0081 0.09 0.0923
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0341 0.0358
Trypanosoma cruzi squalene synthase, putative 0.0242 0.2987 1
Loa Loa (eye worm) hypothetical protein 0.0046 0.044 0.0439
Schistosoma mansoni hypothetical protein 0.0692 0.8814 0.9247
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0152 0.0136
Schistosoma mansoni hypothetical protein 0.0315 0.3935 0.4128
Treponema pallidum fructose-bisphosphate aldolase 0.0308 0.3837 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0079 0.0874 0.0874
Echinococcus multilocularis smad 0.0017 0.0065 0.0065
Entamoeba histolytica hypothetical protein 0.0037 0.0328 0.0803
Brugia malayi TAR-binding protein 0.0068 0.0725 0.0739
Schistosoma mansoni ap endonuclease 0.0023 0.0144 0.0151
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0023 0.0144 0.032
Trichomonas vaginalis conserved hypothetical protein 0.0046 0.044 0.0439
Echinococcus multilocularis isocitrate dehydrogenase 0.0033 0.0278 0.0278
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0033 0.0278 0.0278
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0023 0.0152 0.0152
Trichomonas vaginalis DNA polymerase eta, putative 0.0023 0.0152 0.0136
Echinococcus multilocularis mothers against decapentaplegic 5 0.0017 0.0065 0.0065
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0017 0.0065 0.0068
Echinococcus multilocularis chromodomain helicase DNA binding protein 1 0.0013 0.0022 0.0022
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0121 0.0103
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0013 0.0022 0.0023
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0256 0.3167 0.3307
Entamoeba histolytica hypothetical protein 0.0037 0.0328 0.0803
Loa Loa (eye worm) Smad1 0.0017 0.0065 0.0044
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0022 0.0132 0.0132
Schistosoma mansoni cpg binding protein 0.004 0.0363 0.0381
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0308 0.3837 0.4011
Mycobacterium tuberculosis Conserved protein 0.0038 0.0341 0.0692
Trichomonas vaginalis CAMK family protein kinase 0.0747 0.9532 1
Schistosoma mansoni hypothetical protein 0.0045 0.0438 0.046
Entamoeba histolytica hypothetical protein 0.0037 0.0328 0.0803
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.0144 0.0044
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0184 0.6332
Trichomonas vaginalis importin beta-1, putative 0.0024 0.016 0.0145
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0017 0.0065 0.0065
Schistosoma mansoni cellular tumor antigen P53 0.0049 0.048 0.0503
Schistosoma mansoni smad1 5 8 and 0.0017 0.0065 0.0068
Schistosoma mansoni microtubule-associated protein tau 0.0726 0.9262 0.9717
Echinococcus granulosus zinc finger protein 0.0045 0.0433 0.0454
Schistosoma mansoni hypothetical protein 0.0175 0.2118 0.2222
Echinococcus multilocularis dual specificity serine:threonine tyrosine 0.0747 0.9532 0.9532
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.0341 0.0692
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0144 0.4761
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0341 0.0734
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0033 0.0278 0.0278
Trypanosoma brucei squalene synthase, putative 0.0242 0.2987 1
Trypanosoma brucei DNA polymerase eta, putative 0.0023 0.0152 0.032
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0081 0.0895 0.0895
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0081 0.0895 0.0939
Echinococcus granulosus Chromobox protein 3 0.0013 0.0022 0.0023
Brugia malayi Heterochromatin protein 1 0.0081 0.0903 0.0926
Loa Loa (eye worm) hypothetical protein 0.0122 0.143 0.148
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0133 0.1576 0.1654
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0022 0.0132 0.1524
Loa Loa (eye worm) hypothetical protein 0.0038 0.0341 0.0335
Giardia lamblia Fructose-bisphosphate aldolase 0.0308 0.3837 0.3941
Schistosoma mansoni hypothetical protein 0.0477 0.6031 0.6327
Schistosoma mansoni hypothetical protein 0.0013 0.0022 0.0023
Echinococcus granulosus cpg binding protein 0.004 0.0363 0.0381
Brugia malayi Latrophilin receptor protein 2 0.0081 0.09 0.0923
Brugia malayi RNA binding protein 0.0068 0.0725 0.0739
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0013 0.0022 0.0023
Toxoplasma gondii ABC1 family protein 0.0038 0.0341 0.4444
Schistosoma mansoni cpg binding protein 0.004 0.0363 0.0381
Brugia malayi beta-lactamase 0.0038 0.0341 0.0335
Echinococcus granulosus Smad4 0.0017 0.0065 0.0068
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0308 0.3837 0.4011
Onchocerca volvulus 0.0033 0.0284 0.0275
Echinococcus granulosus GTP binding nuclear protein Ran 0.0022 0.0132 0.0138
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0033 0.0278 0.0514
Loa Loa (eye worm) hypothetical protein 0.009 0.1011 0.104
Schistosoma mansoni cpg binding protein 0.0033 0.0284 0.0298
Echinococcus multilocularis Chromo domain 0.0013 0.0022 0.0022
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0033 0.0278 0.0278
Entamoeba histolytica Ran family GTPase 0.0022 0.0132 0.0287
Schistosoma mansoni smad 0.0017 0.0065 0.0068
Schistosoma mansoni hypothetical protein 0.0037 0.0328 0.0345
Loa Loa (eye worm) MH2 domain-containing protein 0.0017 0.0065 0.0044
Echinococcus granulosus geminin 0.0692 0.8814 0.9247
Loa Loa (eye worm) hypothetical protein 0.0038 0.0341 0.0335
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0121 0.0103
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.0144 0.0044
Echinococcus multilocularis tar DNA binding protein 0.0068 0.0725 0.0725
Brugia malayi Calcitonin receptor-like protein seb-1 0.0256 0.3167 0.3307
Echinococcus granulosus fetal alzheimer antigen falz 0.0051 0.0517 0.0543
Trypanosoma cruzi phytoene synthase, putative 0.0075 0.0828 0.2438
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0017 0.0068 0.0048
Loa Loa (eye worm) hypothetical protein 0.0036 0.0313 0.0305
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0308 0.3837 0.4011
Brugia malayi Bromodomain containing protein 0.0167 0.2012 0.2093
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.0341 0.0692
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0038 0.0336 0.0336
Trypanosoma brucei unspecified product 0.0023 0.0152 0.032
Mycobacterium ulcerans phytoene synthase, CrtB 0.0075 0.0828 0.4135
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0081 0.09 0.0923
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0023 0.0152 0.0027
Mycobacterium ulcerans beta-lactamase 0.0038 0.0341 0.1191
Schistosoma mansoni ran 0.0022 0.0132 0.0138
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0033 0.0278 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.0341 0.0358
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0184 0.0185
Echinococcus multilocularis zinc finger protein 0.0045 0.0433 0.0433
Echinococcus multilocularis chromobox protein 1 0.0081 0.0903 0.0903
Schistosoma mansoni chromobox protein 0.0081 0.0903 0.0947
Mycobacterium ulcerans hypothetical protein 0.0038 0.0341 0.1191
Loa Loa (eye worm) bromodomain containing protein 0.0039 0.0353 0.0348
Loa Loa (eye worm) beta-lactamase 0.0038 0.0341 0.0335
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.0341 0.1191
Loa Loa (eye worm) MH1 domain-containing protein 0.0017 0.0065 0.0044
Trypanosoma cruzi squalene synthase, putative 0.0242 0.2987 1
Schistosoma mansoni terminal deoxycytidyl transferase 0.0023 0.0152 0.0159
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0038 0.0345 0.0362
Brugia malayi chromobox protein homolog 3 0.0046 0.044 0.0439
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0152 0.032
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0328 0.0345
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0184 0.0185
Schistosoma mansoni DNA polymerase eta 0.0023 0.0152 0.0159
Trichomonas vaginalis conserved hypothetical protein 0.0046 0.044 0.0439
Echinococcus granulosus dual specificity serine:threonine tyrosine 0.0747 0.9532 1
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0023 0.0152 0.0159
Loa Loa (eye worm) hypothetical protein 0.0096 0.109 0.1123
Loa Loa (eye worm) hypothetical protein 0.0084 0.0944 0.0969
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0019 0.0101 0.0106
Entamoeba histolytica hypothetical protein 0.0037 0.0328 0.0803
Brugia malayi MH2 domain containing protein 0.0017 0.0065 0.0044
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0033 0.0278 0.0292
Brugia malayi SET domain containing protein 0.0014 0.0032 0.001
Echinococcus granulosus biogenic amine 5HT receptor 0.0122 0.143 0.15
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0341 0.0335
Brugia malayi MH1 domain containing protein 0.0017 0.0065 0.0044
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0081 0.0895 0.0939
Echinococcus multilocularis geminin 0.0692 0.8814 0.8814
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0121 0.0103
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0152 0.032
Schistosoma mansoni hypothetical protein 0.0081 0.09 0.0944
Echinococcus granulosus chromobox protein 1 0.0081 0.0903 0.0947
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0033 0.0278 0.0292
Leishmania major hypothetical protein, conserved 0.0026 0.0184 0.0185
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0328 0.0345
Toxoplasma gondii isocitrate dehydrogenase 0.0033 0.0278 0.357
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0023 0.0144 0.0013
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.0144 0.0144
Schistosoma mansoni importin beta-1 0.003 0.0233 0.0244
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0081 0.0895 0.0939
Brugia malayi Importin beta-1 subunit 0.003 0.0233 0.0221
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0308 0.3837 0.4011
Loa Loa (eye worm) hypothetical protein 0.0081 0.09 0.0923
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0308 0.3837 0.4011
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0033 0.0278 0.0278
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0081 0.09 0.0944
Echinococcus multilocularis snurportin 1 0.0315 0.3935 0.3935
Plasmodium falciparum importin beta, putative 0.003 0.0233 0.8212
Echinococcus granulosus smad 0.0017 0.0065 0.0068
Entamoeba histolytica hypothetical protein 0.0024 0.016 0.0362
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.0341 0.0692
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0233 0.0595
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0308 0.3837 1
Mycobacterium ulcerans lipase LipD 0.0038 0.0341 0.1191
Echinococcus granulosus microtubule associated protein 2 0.0726 0.9262 0.9717
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.0152 0.0047
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0023 0.0152 0.0071
Echinococcus multilocularis cpg binding protein 0.004 0.0363 0.0363
Echinococcus granulosus chromobox protein 2 0.0013 0.0022 0.0023
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.0144 0.0044
Loa Loa (eye worm) MH2 domain-containing protein 0.0243 0.2999 0.313
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0022 0.0132 0.0115
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.0341 0.0335
Mycobacterium tuberculosis Conserved protein 0.0038 0.0341 0.0692
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.0144 0.0294
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0341 0.0335
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0268 0.0258
Brugia malayi RNA recognition motif domain containing protein 0.0068 0.0725 0.0739
Echinococcus multilocularis Smad4 0.0017 0.0065 0.0065
Echinococcus granulosus GPCR family 2 0.0081 0.09 0.0944
Leishmania major hypothetical protein, conserved 0.0038 0.0341 0.0734
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0152 0.032
Trichomonas vaginalis chromobox protein, putative 0.0081 0.0903 0.0926
Schistosoma mansoni ran 0.0022 0.0132 0.0138
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.0341 0.0692
Brugia malayi Isocitrate dehydrogenase 0.0033 0.0278 0.0269
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0152 0.032
Brugia malayi MH1 domain containing protein 0.0017 0.0065 0.0044
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.016 0.01
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0233 0.0595
Loa Loa (eye worm) hypothetical protein 0.0023 0.0152 0.0136
Echinococcus granulosus methyl CpG binding domain protein 2 0.0038 0.0336 0.0353
Onchocerca volvulus 0.0038 0.0341 0.0335
Echinococcus multilocularis chromobox protein 2 0.0013 0.0022 0.0022
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0033 0.0278 0.0472
Echinococcus granulosus Chromo domain 0.0013 0.0022 0.0023
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0022 0.0132 0.4267
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0033 0.0278 0.0514
Entamoeba histolytica deoxycytidyl transferase, putative 0.0023 0.0152 0.034
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0022 0.0132 0.025
Echinococcus multilocularis dnaJ subfamily B 0.0477 0.6031 0.6031
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0341 0.0358
Brugia malayi PHD-finger family protein 0.0057 0.0585 0.0591
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0152 0.0136
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.0184 0.2261
Plasmodium vivax importin-beta 2, putative 0.003 0.0233 0.6598
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0133 0.1576 0.1576
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.0341 0.0341
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0152 0.032
Schistosoma mansoni tar DNA-binding protein 0.0068 0.0725 0.0761
Onchocerca volvulus 0.0036 0.0313 0.0305
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0144 0.0128
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0071 0.077 0.0808
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0152 0.032
Onchocerca volvulus 0.0049 0.048 0.0481
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0341 0.0335
Loa Loa (eye worm) hypothetical protein 0.0049 0.048 0.0481
Echinococcus granulosus mothers against decapentaplegic 5 0.0017 0.0065 0.0068
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0046 0.044 0.0439
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0152 0.0071
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.015 0.1797 0.5815
Loa Loa (eye worm) TTK protein kinase 0.0747 0.9532 1
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0315 0.3935 0.4114
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0341 0.0335
Trichomonas vaginalis chromobox protein, putative 0.0081 0.0903 0.0926
Brugia malayi hypothetical protein 0.0037 0.0328 0.0322
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0013 0.0022 0.0023
Loa Loa (eye worm) hypothetical protein 0.0026 0.0184 0.0171
Loa Loa (eye worm) hypothetical protein 0.0175 0.2118 0.2203
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0038 0.0345 0.0362
Echinococcus multilocularis GPCR, family 2 0.0081 0.09 0.09
Giardia lamblia Kinase, TTK 0.0747 0.9532 1
Brugia malayi MH2 domain containing protein 0.0243 0.2999 0.313
Loa Loa (eye worm) hypothetical protein 0.0038 0.0345 0.034
Toxoplasma gondii exonuclease III APE 0.0023 0.0144 0.17
Loa Loa (eye worm) hypothetical protein 0.0038 0.0341 0.0335
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0184 0.5087
Leishmania major DNA polymerase eta, putative 0.0023 0.0152 0.0071
Onchocerca volvulus 0.0038 0.0341 0.0335
Loa Loa (eye worm) hypothetical protein 0.0256 0.3167 0.3307
Loa Loa (eye worm) CHromoDomain protein family member 0.0019 0.0101 0.0083
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.015 0.1797 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0328 0.0328
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0021 0.0121 0.0103
Schistosoma mansoni zinc finger protein 0.0034 0.0286 0.03
Brugia malayi hypothetical protein 0.0017 0.0066 0.0046
Schistosoma mansoni hypothetical protein 0.0081 0.09 0.0944
Toxoplasma gondii HEAT repeat-containing protein 0.003 0.0233 0.2932
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0021 0.0121 0.0103
Trypanosoma brucei ISWI complex protein 0.0034 0.0286 0.0778
Echinococcus granulosus Squalene phytoene synthase 0.0075 0.0828 0.0868
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0023 0.0152 0.0159
Loa Loa (eye worm) transcription factor SMAD2 0.0243 0.2999 0.313
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0152 0.032
Onchocerca volvulus NADH dehydrogenase (ubiquinone) complex I, assembly factor 6 homolog 0.0075 0.0828 0.0847
Loa Loa (eye worm) hypothetical protein 0.0156 0.1866 0.1938
Brugia malayi CXXC zinc finger family protein 0.0033 0.0284 0.0275
Echinococcus granulosus tar DNA binding protein 0.0068 0.0725 0.0761
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0051 0.0517 0.0543
Loa Loa (eye worm) hypothetical protein 0.003 0.0233 0.0221
Schistosoma mansoni methyl-cpg binding protein mbd 0.0038 0.0336 0.0353
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0121 0.0103
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.015 0.1797 1
Trypanosoma cruzi ISWI complex protein 0.0034 0.0286 0.0541

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 79.4328 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) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Human Flap endonuclease 1 (FEN1). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488813] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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