Detailed information for compound 1067225

Basic information

Technical information
  • TDR Targets ID: 1067225
  • Name: [2-[(1,1-dioxothiolan-3-yl)amino]-2-oxoethyl] 2-(5-methyl-2-propan-2-ylphenoxy)acetate
  • MW: 383.459 | Formula: C18H25NO6S
  • H donors: 1 H acceptors: 4 LogP: 2.22 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(NC1CCS(=O)(=O)C1)COC(=O)COc1cc(C)ccc1C(C)C
  • InChi: 1S/C18H25NO6S/c1-12(2)15-5-4-13(3)8-16(15)24-10-18(21)25-9-17(20)19-14-6-7-26(22,23)11-14/h4-5,8,12,14H,6-7,9-11H2,1-3H3,(H,19,20)
  • InChiKey: XPUMGJCBDKCVBI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • [2-[(1,1-dioxothiolan-3-yl)amino]-2-oxo-ethyl] 2-(2-isopropyl-5-methyl-phenoxy)acetate
  • 2-(2-isopropyl-5-methylphenoxy)acetic acid [2-[(1,1-dioxo-3-thiolanyl)amino]-2-oxoethyl] ester
  • 2-(2-isopropyl-5-methyl-phenoxy)acetic acid [2-[(1,1-diketothiolan-3-yl)amino]-2-keto-ethyl] ester
  • [2-[(1,1-dioxothiolan-3-yl)amino]-2-oxo-ethyl] 2-(5-methyl-2-propan-2-yl-phenoxy)ethanoate

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
Schistosoma mansoni hypothetical protein 0.0385 0.2414 0.8225
Schistosoma mansoni survival motor neuron protein 0.0053 0.0262 0.0893
Trichomonas vaginalis heat shock protein, putative 0.0047 0.0224 0.1262
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0021 0.0055 0.0541
Plasmodium vivax endoplasmin, putative 0.005 0.0244 0.1972
Mycobacterium leprae PROBABLE CHAPERONE PROTEIN HTPG (HEAT SHOCK PROTEIN) (HSP90 FAMILY PROTEIN) (HIGH TEMPERATURE PROTEIN G) 0.0047 0.0224 1
Loa Loa (eye worm) TAR-binding protein 0.0144 0.085 0.0836
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0055 0.0245
Trypanosoma brucei heat shock protein 90, putative 0.005 0.0244 0.1049
Plasmodium falciparum ataxin-2 like protein, putative 0.0029 0.0102 0.0728
Plasmodium vivax heat shock protein 86, putative 0.005 0.0244 0.1972
Schistosoma mansoni family C54 unassigned peptidase (C54 family) 0.0134 0.0786 0.2677
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Brugia malayi Calcitonin receptor-like protein seb-1 0.017 0.1019 0.3436
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0025 0.0076 0.0259
Schistosoma mansoni hypothetical protein 0.0054 0.0265 0.0904
Loa Loa (eye worm) hypothetical protein 0.0404 0.254 0.2528
Schistosoma mansoni hypothetical protein 0.0116 0.067 0.2283
Trichomonas vaginalis helicase, putative 0.0021 0.0055 0.0245
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0239 0.1464 0.1451
Trypanosoma brucei heat shock protein, putative 0.005 0.0244 0.1049
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0055 0.0245
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0047 0.0224 0.0957
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0031 0.0118 0.0403
Onchocerca volvulus 0.0353 0.2206 0.2112
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0036 0.0153 0.0635
Echinococcus multilocularis heat shock protein 90 0.005 0.0244 0.0831
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0025 0.0076 0.0259
Leishmania major GTP-binding protein, putative 0.0023 0.0063 0.0222
Brugia malayi Platelet-activating factor acetylhydrolase, plasma/intracellular isoform II family protein 0.0353 0.2206 0.7501
Brugia malayi vesicular acetylcholine transporter unc-17 0.0465 0.2935 1
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Trichomonas vaginalis DNA helicase recq, putative 0.0028 0.0099 0.0511
Schistosoma mansoni hypothetical protein 0.0015 0.0016 0.0054
Trypanosoma cruzi AUT2/APG4/ATG4 cysteine peptidase, putative 0.0134 0.0786 0.3522
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0021 0.0055 0.0039
Schistosoma mansoni hypothetical protein 0.0327 0.2036 0.6936
Loa Loa (eye worm) hypothetical protein 0.0054 0.0265 0.025
Trypanosoma brucei Sterol methyltransferase, putative 0.02 0.1214 0.5474
Loa Loa (eye worm) jmjC domain-containing protein 0.0043 0.0195 0.018
Schistosoma mansoni importin beta-1 0.0031 0.0115 0.0392
Loa Loa (eye worm) endoplasmin 0.005 0.0244 0.0228
Brugia malayi hypothetical protein 0.0029 0.0102 0.0297
Schistosoma mansoni tar DNA-binding protein 0.0144 0.085 0.2897
Brugia malayi hypothetical protein 0.0261 0.161 0.5462
Loa Loa (eye worm) hypothetical protein 0.0016 0.0017 0.0001
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0021 0.0055 0.0162
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.003 0.0113 0.0386
Echinococcus granulosus bloom syndrome protein 0.0028 0.0099 0.0337
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.0055 0.0248
Loa Loa (eye worm) CXXC zinc finger family protein 0.0094 0.0526 0.0511
Plasmodium vivax ataxin-2 like protein, putative 0.0029 0.0102 0.0728
Echinococcus granulosus peregrin 0.0031 0.0118 0.0403
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0055 0.0245
Entamoeba histolytica heat shock protein 90, putative 0.005 0.0244 0.0904
Brugia malayi Hsp90 protein 0.0034 0.0134 0.0405
Trypanosoma brucei PAB1-binding protein , putative 0.0029 0.0102 0.0403
Brugia malayi Peptidase family C54 containing protein 0.0134 0.0786 0.2638
Echinococcus multilocularis heat shock protein 75 kDa, mitochondrial 0.0034 0.0134 0.0457
Brugia malayi Bloom's syndrome protein homolog 0.0028 0.0099 0.0285
Entamoeba histolytica hypothetical protein 0.0116 0.0668 0.2571
Trypanosoma brucei lanosterol synthase 0.0192 0.1162 0.5238
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0036 0.0153 0.1884
Trypanosoma cruzi PAB1-binding protein , putative 0.0029 0.0102 0.0403
Trypanosoma cruzi lanosterol synthase, putative 0.0192 0.1162 0.5238
Echinococcus granulosus endoplasmin 0.0047 0.0224 0.0763
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0054 0.0265 0.0904
Echinococcus multilocularis cysteine protease atg4b 0.0134 0.0786 0.2677
Giardia lamblia Heat shock protein HSP 90-alpha 0.005 0.0244 0.0754
Brugia malayi heat shock protein 90 0.005 0.0244 0.0781
Trypanosoma cruzi cytochrome P450, putative 0.0015 0.0016 0.0008
Loa Loa (eye worm) hypothetical protein 0.017 0.1019 0.1005
Schistosoma mansoni hypothetical protein 0.0053 0.0262 0.0893
Brugia malayi PHD-finger family protein 0.0016 0.0017 0.0005
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0054 0.0265 0.0855
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Echinococcus multilocularis bloom syndrome protein 0.0028 0.0099 0.0337
Trypanosoma brucei heat shock protein, putative 0.005 0.0244 0.1049
Loa Loa (eye worm) heat shock protein 75 0.0034 0.0134 0.0118
Loa Loa (eye worm) pigment dispersing factor receptor c 0.017 0.1019 0.1005
Entamoeba histolytica peptidase, C54 family 0.0052 0.0256 0.095
Brugia malayi Pre-SET motif family protein 0.0239 0.1464 0.4962
Trypanosoma brucei heat shock protein, putative 0.005 0.0244 0.1049
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0055 0.0245
Trichomonas vaginalis ran, putative 0.0023 0.0063 0.0293
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0023 0.0063 0.0222
Trypanosoma cruzi AUT2/APG4/ATG4 cysteine peptidase, putative 0.0052 0.0256 0.1102
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0201 0.1217 0.4148
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0036 0.0153 0.0522
Plasmodium falciparum heat shock protein 90 0.005 0.0244 0.1972
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Entamoeba histolytica peptidase, C54 family 0.0134 0.0786 0.3034
Toxoplasma gondii heat shock protein 90, putative 0.005 0.0244 0.1998
Onchocerca volvulus 0.0053 0.0262 0.0146
Loa Loa (eye worm) hypothetical protein 0.0031 0.0115 0.0099
Echinococcus granulosus geminin 0.0385 0.2414 0.8225
Giardia lamblia Heat shock protein HSP 90-alpha 0.0043 0.0197 0.0565
Echinococcus multilocularis geminin 0.0385 0.2414 0.8225
Schistosoma mansoni ran 0.0023 0.0063 0.0214
Schistosoma mansoni ap endonuclease 0.0021 0.0055 0.0188
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0021 0.0055 0.0245
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0055 0.0245
Echinococcus granulosus cytochrome P450 2K1 0.0015 0.0016 0.0054
Trypanosoma brucei sterol 24-c-methyltransferase, putative 0.02 0.1214 0.5474
Entamoeba histolytica hypothetical protein 0.0041 0.0182 0.066
Schistosoma mansoni heat shock protein 0.005 0.0244 0.0831
Plasmodium falciparum phd finger protein, putative 0.0031 0.0118 0.0866
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0118 0.0896
Toxoplasma gondii heat shock protein HSP90 0.005 0.0244 0.1998
Trichomonas vaginalis heat shock protein, putative 0.0043 0.0197 0.1098
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0041 0.0182 0.062
Brugia malayi isocitrate dehydrogenase 0.0036 0.0153 0.047
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.015 0.1176
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0015 0.0012 0.0041
Echinococcus multilocularis dnaJ subfamily B 0.0465 0.2932 0.9991
Schistosoma mansoni tar DNA-binding protein 0.0144 0.085 0.2897
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0015 0.0016 0.0056
Schistosoma mansoni cpg binding protein 0.0099 0.0561 0.1911
Trypanosoma cruzi phospholipase A1, putative 0.0353 0.2206 1
Trypanosoma cruzi heat shock protein 85, putative 0.005 0.0244 0.1049
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0021 0.0055 0.1896
Trypanosoma cruzi phospholipase A1, putative 0.0353 0.2206 1
Trypanosoma cruzi sterol 24-c-methyltransferase, putative 0.02 0.1214 0.5474
Leishmania major importin beta-1 subunit, putative 0.0025 0.0078 0.029
Echinococcus granulosus Peptidase C54 0.0134 0.0786 0.2677
Trypanosoma brucei heat shock protein, putative 0.005 0.0244 0.1049
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0023 0.0063 0.003
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.0078 0.0382
Trypanosoma brucei heat shock protein 84, putative 0.0034 0.0134 0.0548
Brugia malayi RNA recognition motif domain containing protein 0.0144 0.085 0.2858
Toxoplasma gondii heat shock protein 75, putative 0.0034 0.0134 0.1036
Trypanosoma brucei importin beta-1 subunit, putative 0.0031 0.0115 0.0461
Echinococcus multilocularis importin subunit beta 1 0.0031 0.0115 0.0392
Echinococcus multilocularis Peptidase C54 0.0134 0.0786 0.2677
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0041 0.0182 0.062
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0036 0.0153 0.1174
Echinococcus multilocularis peregrin 0.0031 0.0118 0.0403
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0023 0.0063 0.0379
Echinococcus multilocularis lysine specific demethylase 5A 0.0038 0.0161 0.0547
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0054 0.0265 0.0904
Echinococcus multilocularis PHD finger protein rhinoceros 0.0031 0.0118 0.0403
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0023 0.0063 0.0379
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0015 0.0016 0.0008
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0021 0.0055 0.0188
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0195 0.0665
Trichomonas vaginalis importin beta-1, putative 0.0025 0.0078 0.0382
Schistosoma mansoni hypothetical protein 0.0054 0.0265 0.0904
Leishmania major AUT2/APG4/ATG4 cysteine peptidase, putative 0.0134 0.0786 0.3522
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0021 0.0055 0.0188
Schistosoma mansoni endoplasmin 0.005 0.0244 0.0831
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0055 0.0245
Loa Loa (eye worm) vesicular acetylcholine transporter unc-17 0.0465 0.2935 0.2924
Trichomonas vaginalis heat shock protein, putative 0.0037 0.0154 0.0843
Loa Loa (eye worm) hypothetical protein 0.0029 0.0102 0.0087
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0036 0.0153 0.1174
Trichomonas vaginalis endoplasmin, putative 0.0037 0.0154 0.0843
Trypanosoma cruzi phospholipase A2-like protein, putative 0.0162 0.0966 0.4345
Trypanosoma brucei heat shock protein, putative 0.005 0.0244 0.1049
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.0055 0.0248
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0134 0.0786 0.4643
Echinococcus granulosus snurportin 1 0.0327 0.2036 0.6936
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Trypanosoma cruzi heat shock protein, putative 0.0034 0.0134 0.0548
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0021 0.0055 0.0188
Schistosoma mansoni cpg binding protein 0.0099 0.0561 0.1911
Schistosoma mansoni autophagin-1 (C54 family) 0.0134 0.0786 0.2677
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0023 0.0063 0.0411
Loa Loa (eye worm) hypothetical protein 0.0097 0.0549 0.0534
Leishmania major AUT2/APG4/ATG4 cysteine peptidase, putative 0.0052 0.0256 0.1102
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0036 0.0153 0.0522
Brugia malayi CXXC zinc finger family protein 0.0094 0.0526 0.1748
Trypanosoma cruzi sterol 24-c-methyltransferase, putative 0.02 0.1214 0.5474
Brugia malayi Bromodomain containing protein 0.0031 0.0118 0.035
Schistosoma mansoni family C54 unassigned peptidase (C54 family) 0.0134 0.0786 0.2677
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0102 0.0577 0.1965
Schistosoma mansoni hypothetical protein 0.0031 0.0118 0.0403
Brugia malayi RNA binding protein 0.0144 0.085 0.2858
Onchocerca volvulus 0.0094 0.0526 0.0413
Trypanosoma brucei heat shock protein, putative 0.005 0.0244 0.1049
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Schistosoma mansoni tar DNA-binding protein 0.0144 0.085 0.2897
Schistosoma mansoni hypothetical protein 0.0385 0.2414 0.8225
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.0078 0.0382
Loa Loa (eye worm) hypothetical protein 0.0053 0.0262 0.0247
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0055 0.0245
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0043 0.0197 0.067
Entamoeba histolytica hypothetical protein 0.0041 0.0182 0.066
Giardia lamblia PHD finger protein 15 0.0031 0.0118 0.0251
Loa Loa (eye worm) RNA binding protein 0.0144 0.085 0.0836
Echinococcus multilocularis heat shock protein 0.005 0.0244 0.0831
Brugia malayi TAR-binding protein 0.0144 0.085 0.2858
Brugia malayi Latrophilin receptor protein 2 0.0054 0.0265 0.0855
Leishmania major hypothetical protein, conserved 0.0029 0.0102 0.0403
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.017 0.1019 0.3436
Brugia malayi Cytochrome P450 family protein 0.0037 0.0157 0.0482
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0025 0.0076 0.0259
Loa Loa (eye worm) hypothetical protein 0.0036 0.015 0.0134
Schistosoma mansoni cpg binding protein 0.0094 0.0526 0.1792
Leishmania major sterol 24-c-methyltransferase, putative 0.02 0.1214 0.5474
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0134 0.0786 0.4643
Trypanosoma brucei Heat shock protein 83, putative 0.005 0.0244 0.1049
Echinococcus multilocularis GPCR, family 2 0.0054 0.0265 0.0904
Brugia malayi Isocitrate dehydrogenase 0.0036 0.0153 0.047
Echinococcus multilocularis endoplasmin 0.0047 0.0224 0.0763
Echinococcus granulosus lysine specific demethylase 5A 0.0043 0.0195 0.0665
Echinococcus granulosus heat shock protein 90 0.0043 0.0197 0.067
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0036 0.0153 0.0635
Echinococcus multilocularis snurportin 1 0.0327 0.2036 0.6936
Trypanosoma cruzi PAB1-binding protein , putative 0.0029 0.0102 0.0403
Entamoeba histolytica hypothetical protein 0.0041 0.0182 0.066
Schistosoma mansoni blooms syndrome DNA helicase 0.0022 0.0061 0.0207
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0021 0.0055 0.0188
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0023 0.0063 0.0161
Echinococcus multilocularis tar DNA binding protein 0.0144 0.085 0.2897
Echinococcus granulosus cysteine protease atg4b 0.0134 0.0786 0.2677
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Brugia malayi Endoplasmin precursor 0.005 0.0244 0.0781
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.015 0.0511
Treponema pallidum heat shock protein 90 0.0047 0.0224 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0029 0.0102 0.0728
Onchocerca volvulus Phospholipase A2 homolog 0.0404 0.254 0.245
Leishmania major cytochrome p450-like protein 0.0015 0.0016 0.0008
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0023 0.0063 0.0047
Loa Loa (eye worm) jmjC domain-containing protein 0.0064 0.0333 0.0317
Leishmania major heat shock protein, putative 0.0034 0.0134 0.0548
Entamoeba histolytica peptidase, C54 family 0.0052 0.0256 0.095
Plasmodium falciparum heat shock protein 90, putative 0.0029 0.0107 0.0767
Entamoeba histolytica peptidase, C54 family 0.0052 0.0256 0.095
Trypanosoma cruzi Heat shock protein 83, putative 0.005 0.0244 0.1049
Loa Loa (eye worm) hypothetical protein 0.0141 0.0835 0.082
Onchocerca volvulus Phospholipase A2 homolog 0.1554 1 1
Giardia lamblia Grp94/Hsp90 0.0047 0.0224 0.0673
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0054 0.0265 0.0904
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0134 0.0786 0.4643
Schistosoma mansoni transcription factor LCR-F1 0.0041 0.0182 0.062
Loa Loa (eye worm) isocitrate dehydrogenase 0.0036 0.0153 0.0137
Toxoplasma gondii isocitrate dehydrogenase 0.0036 0.0153 0.1203
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.015 0.0511
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0023 0.0063 0.0214
Schistosoma mansoni cytochrome P450 0.0015 0.0016 0.0054
Brugia malayi hypothetical protein 0.0018 0.0037 0.0071
Echinococcus granulosus PHD finger protein rhinoceros 0.0031 0.0118 0.0403
Loa Loa (eye worm) RecQ helicase 0.0028 0.0099 0.0083
Onchocerca volvulus 0.0036 0.015 0.0032
Schistosoma mansoni hypothetical protein 0.0054 0.0265 0.0904
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.0055 0.0313
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0195 0.0665
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Trypanosoma brucei cytochrome P450, putative 0.0015 0.0016 0.0008
Trypanosoma cruzi heat shock protein 85, putative 0.005 0.0244 0.1049
Echinococcus multilocularis heat shock protein 90 0.0043 0.0197 0.067
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0035 0.0142 0.0484
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0021 0.0055 0.0188
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0036 0.015 0.0511
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0019 0.0038 0.0198
Onchocerca volvulus Vesicular acetylcholine transporter homolog 0.0465 0.2935 0.2851
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 0.0047 0.0224 1
Brugia malayi PHD-finger family protein 0.0031 0.0118 0.035
Entamoeba histolytica Ran family GTPase 0.0023 0.0063 0.0191
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0036 0.0153 0.0635
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.015 0.0511
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0327 0.2036 0.2023
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0025 0.0077 0.0503
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0036 0.0153 0.0522
Schistosoma mansoni vesicular acetylcholine transporter 0.0465 0.2935 1
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0023 0.0063 0.0222
Brugia malayi jmjC domain containing protein 0.0043 0.0195 0.0615
Brugia malayi F/Y-rich N-terminus family protein 0.004 0.0177 0.0551
Toxoplasma gondii histone lysine methyltransferase SET1 0.0179 0.1079 0.9319
Giardia lamblia DNA repair protein RAD52 0.0407 0.2557 1
Echinococcus granulosus GTP binding nuclear protein Ran 0.0023 0.0063 0.0214
Trypanosoma cruzi lanosterol synthase, putative 0.0192 0.1162 0.5238
Schistosoma mansoni heat shock protein 0.0034 0.0134 0.0457
Echinococcus granulosus survival motor neuron protein 1 0.0261 0.161 0.5486
Trypanosoma cruzi importin beta-1 subunit, putative 0.0025 0.0078 0.029
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0019 0.004 0.0178
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0055 0.0245
Echinococcus multilocularis isocitrate dehydrogenase 0.0036 0.0153 0.0522
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.0129 0.0438
Plasmodium vivax heat shock protein, putative 0.0191 0.1157 1
Trypanosoma brucei heat shock protein, putative 0.005 0.0244 0.1049
Echinococcus granulosus heat shock protein 75 kDa mitochondrial 0.0034 0.0134 0.0457
Plasmodium vivax hypothetical protein, conserved 0.0031 0.0118 0.0866
Trypanosoma cruzi cytochrome P450, putative 0.0015 0.0016 0.0008
Toxoplasma gondii HEAT repeat-containing protein 0.0031 0.0115 0.087
Brugia malayi exodeoxyribonuclease III family protein 0.0021 0.0055 0.0135
Leishmania major phospholipase A1, putative 0.0353 0.2206 1
Echinococcus multilocularis survival motor neuron protein 1 0.0261 0.161 0.5486
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0036 0.0153 0.0522
Toxoplasma gondii exonuclease III APE 0.0021 0.0055 0.0346
Mycobacterium tuberculosis Halimadienyl diphosphate synthase 0.0128 0.0745 1
Plasmodium falciparum endoplasmin, putative 0.0037 0.0154 0.1183
Schistosoma mansoni hypothetical protein 0.0465 0.2932 0.9991
Brugia malayi jmjC domain containing protein 0.0102 0.0577 0.1921
Loa Loa (eye worm) histone methyltransferase 0.003 0.0113 0.0098
Loa Loa (eye worm) hypothetical protein 0.0116 0.067 0.0655
Echinococcus granulosus mixed lineage leukemia protein mll 0.0025 0.0076 0.0259
Trypanosoma cruzi sterol 24-c-methyltransferase, putative 0.02 0.1214 0.5474
Plasmodium vivax importin-beta 2, putative 0.0031 0.0115 0.084
Echinococcus granulosus importin subunit beta 1 0.0031 0.0115 0.0392
Trypanosoma cruzi cysteine peptidase, Clan CA, family C54, putative 0.0052 0.0256 0.1102
Trypanosoma cruzi phospholipase A2-like protein, putative 0.0162 0.0966 0.4345
Onchocerca volvulus 0.0353 0.2206 0.2112
Schistosoma mansoni hypothetical protein 0.0041 0.0182 0.062
Loa Loa (eye worm) hypothetical protein 0.0031 0.0118 0.0102
Loa Loa (eye worm) platelet-activating factor acetylhydrolase 0.0353 0.2206 0.2193
Trypanosoma brucei sterol 24-c-methyltransferase, putative 0.02 0.1214 0.5474
Echinococcus multilocularis cpg binding protein 0.0099 0.0561 0.1911
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.015 0.0511
Entamoeba histolytica DNA repair and recombination protein RAD52, putative 0.0407 0.2557 1
Mycobacterium tuberculosis Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G) 0.0047 0.0224 0.2854
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.015 0.0511
Schistosoma mansoni hypothetical protein 0.0054 0.0265 0.0904
Trypanosoma cruzi heat shock protein 90, putative 0.0043 0.0197 0.0833
Echinococcus granulosus vesicular acetylcholine transporter 0.0465 0.2935 1
Brugia malayi Importin beta-1 subunit 0.0031 0.0115 0.034
Trypanosoma brucei AUT2/APG4/ATG4 cysteine peptidase, putative 0.0134 0.0786 0.3522
Leishmania major cytochrome p450-like protein 0.0015 0.0016 0.0008
Schistosoma mansoni tar DNA-binding protein 0.0144 0.085 0.2897
Trypanosoma brucei heat shock protein 90, putative 0.005 0.0244 0.1049
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0015 0.0016 0.0056
Brugia malayi hypothetical protein 0.0041 0.0182 0.0569
Leishmania major sterol 24-c-methyltransferase, putative 0.02 0.1214 0.5474
Trichomonas vaginalis set domain proteins, putative 0.0271 0.1676 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0055 0.0245
Plasmodium vivax heat shock protein 90, putative 0.0034 0.0134 0.1006
Toxoplasma gondii Hsp90 domain-containing protein 0.0191 0.1157 1
Schistosoma mansoni endoplasmin 0.005 0.0244 0.0831
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0053 0.0262 0.0843
Loa Loa (eye worm) heat shock protein 90 0.005 0.0244 0.0228
Loa Loa (eye worm) hypothetical protein 0.0134 0.0786 0.0771
Entamoeba histolytica Rad52/22 family double-strand break repair protein, putative 0.0116 0.0668 0.2571
Trypanosoma brucei phospholipase A1, putative 0.0353 0.2206 1
Echinococcus granulosus GPCR family 2 0.0054 0.0265 0.0904
Trypanosoma cruzi heat shock protein 85, putative 0.0043 0.0197 0.0833
Trichomonas vaginalis heat shock protein, putative 0.0029 0.0107 0.0558
Onchocerca volvulus 0.0271 0.1676 0.1577
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0102 0.0577 0.1965
Trypanosoma brucei cysteine peptidase, Clan CA, family C54, putative 0.0052 0.0256 0.1102
Leishmania major cytochrome p450-like protein 0.0015 0.0016 0.0008
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0055 0.0245
Schistosoma mansoni ap endonuclease 0.0021 0.0055 0.0188
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.015 0.0511
Plasmodium vivax SET domain protein, putative 0.0036 0.015 0.1146
Echinococcus multilocularis vesicular acetylcholine transporter 0.0465 0.2935 1
Toxoplasma gondii autophagy-related cysteine peptidase atg4, putative 0.0052 0.0256 0.2101
Trichomonas vaginalis heat shock protein, putative 0.0047 0.0224 0.1262
Brugia malayi Phospholipase A2 family protein 0.0404 0.254 0.8645
Schistosoma mansoni tar DNA-binding protein 0.0144 0.085 0.2897
Trypanosoma cruzi heat shock protein 90, putative 0.005 0.0244 0.1049
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Trypanosoma brucei sterol 24-c-methyltransferase, putative 0.0104 0.0593 0.2642
Echinococcus granulosus heat shock protein 0.005 0.0244 0.0831
Echinococcus multilocularis jumonji domain containing protein 0.0043 0.0197 0.0671
Echinococcus granulosus tar DNA binding protein 0.0144 0.085 0.2897
Trichomonas vaginalis heat shock protein, putative 0.005 0.0244 0.1383
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0036 0.0153 0.0522
Echinococcus granulosus heat shock protein 90 0.005 0.0244 0.0831
Mycobacterium ulcerans heat shock protein 90 0.0047 0.0224 1
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0023 0.0063 0.0222
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0054 0.0265 0.0904
Echinococcus granulosus dnaJ subfamily B 0.0465 0.2932 0.9991
Entamoeba histolytica 90 kDa heat shock protein, putative 0.0034 0.0134 0.0472
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0021 0.0055 0.0188
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.0055 0.0313
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0036 0.0153 0.0522
Echinococcus granulosus jumonji domain containing protein 0.0043 0.0197 0.0671
Trypanosoma brucei heat shock protein, putative 0.005 0.0244 0.1049
Leishmania major lanosterol synthase, putative 0.0192 0.1162 0.5238
Plasmodium falciparum heat shock protein 90, putative 0.0191 0.1157 1
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Onchocerca volvulus 0.0353 0.2206 0.2112
Schistosoma mansoni ran 0.0023 0.0063 0.0214
Trichomonas vaginalis DNA helicase recq1, putative 0.0028 0.0099 0.0511
Toxoplasma gondii LsmAD domain-containing protein 0.0029 0.0102 0.0759
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0134 0.0786 0.4643
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0055 0.0245
Toxoplasma gondii isocitrate dehydrogenase 0.0036 0.0153 0.1203
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0015 0.0016 0.0008
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0144 0.085 0.0836
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0036 0.0153 0.0635
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0015 0.0016 0.0008
Echinococcus multilocularis 0.0015 0.0016 0.0054
Schistosoma mansoni heat shock protein 0.005 0.0244 0.0831
Entamoeba histolytica hypothetical protein 0.0025 0.0078 0.025
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0055 0.0245
Loa Loa (eye worm) hypothetical protein 0.0261 0.161 0.1597
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0118 0.0896
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0015 0.0016 0.0008
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0021 0.0055 0.0245
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0134 0.0786 0.4643
Loa Loa (eye worm) latrophilin receptor protein 2 0.0054 0.0265 0.025
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.003 0.0113 0.0386
Plasmodium falciparum importin beta, putative 0.0031 0.0115 0.084
Brugia malayi Pre-SET motif family protein 0.0036 0.015 0.046
Brugia malayi RNA, U transporter 1 0.0087 0.0481 0.1594
Trypanosoma cruzi heat shock protein 90, putative 0.0021 0.0054 0.0181
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0055 0.0245
Trypanosoma brucei importin beta-1 subunit, putative 0.0031 0.0115 0.0461
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0036 0.0153 0.0635
Loa Loa (eye worm) cytochrome P450 family protein 0.0037 0.0157 0.0141
Entamoeba histolytica heat shock protein 90, putative 0.005 0.0244 0.0904
Echinococcus granulosus cpg binding protein 0.0099 0.0561 0.1911
Onchocerca volvulus Heat shock protein 75 kDa, mitochondrial homolog 0.0034 0.0134 0.0016
Plasmodium falciparum cysteine protease ATG4, putative 0.0052 0.0256 0.2075
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0055 0.0245
Brugia malayi latrophilin 2 splice variant baaae 0.0116 0.067 0.2241
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0055 0.0245
Loa Loa (eye worm) PHD-finger family protein 0.0031 0.0118 0.0102
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0015 0.0016 0.0008
Schistosoma mansoni jumonji domain containing protein 0.0081 0.0441 0.1502
Trypanosoma cruzi heat shock protein 85, putative 0.005 0.0244 0.1049
Brugia malayi S-adenosyl-methionine cycloartenol-C24-methyltransferase 0.0097 0.0549 0.1826
Entamoeba histolytica hypothetical protein 0.0041 0.0182 0.066
Leishmania major heat shock protein 83-1 0.005 0.0244 0.1049
Entamoeba histolytica peptidase, C54 family 0.0052 0.0256 0.095

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 22.3872 uM PubChem BioAssay. qHTS for Inhibitors of Glutaminase (GLS). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 125.8925 uM PubChem BioAssay. qHTS for Agonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory) 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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