Detailed information for compound 1578518

Basic information

Technical information
  • TDR Targets ID: 1578518
  • Name: ethyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-en oate
  • MW: 266.29 | Formula: C14H18O5
  • H donors: 0 H acceptors: 1 LogP: 2.48 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)/C=C/c1cc(OC)c(c(c1)OC)OC
  • InChi: 1S/C14H18O5/c1-5-19-13(15)7-6-10-8-11(16-2)14(18-4)12(9-10)17-3/h6-9H,5H2,1-4H3/b7-6+
  • InChiKey: WZFPTWWCXRADLD-VOTSOKGWSA-N  


Substructure search Similarity search

Network

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Synonyms

  • ethyl 3-(3,4,5-trimethoxyphenyl)prop-2-enoate
  • (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid ethyl ester
  • 3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid ethyl ester
  • (E)-3-(3,4,5-trimethoxyphenyl)acrylic acid ethyl ester
  • 3-(3,4,5-trimethoxyphenyl)acrylic acid ethyl ester
  • 1878-29-1
  • EINECS 217-516-9
  • Ethyl 3-(3,4,5-trimethoxyphenyl)acrylate
  • ZINC00162597

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
Echinococcus multilocularis acetylcholinesterase 0.0747 0.7343 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0239 0.0316
Onchocerca volvulus 0.0126 0.1108 1
Brugia malayi amine oxidase, flavin-containing family protein 0.0071 0.0556 0.0758
Loa Loa (eye worm) jmjC domain-containing protein 0.0024 0.0086 0.0107
Schistosoma mansoni protein phosphatase 2C 0.0024 0.0086 0.0107
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0028 0.0126 0.0161
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0043 0.0048
Trypanosoma brucei heat shock protein, putative 0.0032 0.0159 1
Loa Loa (eye worm) hypothetical protein 0.0071 0.0556 0.0748
Echinococcus granulosus JmjC domain containing protein 4 0.0024 0.0086 0.0107
Loa Loa (eye worm) hypothetical protein 0.0126 0.1108 0.1501
Mycobacterium ulcerans monoamine oxidase 0.0071 0.0556 0.0467
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0054 0.0381 0.0509
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0026 0.0105 0.0133
Echinococcus granulosus jumonji domain containing 1A 0.0024 0.0086 0.0107
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Schistosoma mansoni jumonji/arid domain-containing protein 0.0094 0.078 0.1053
Echinococcus multilocularis neuroligin 0.0126 0.1108 0.1501
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.27 1
Loa Loa (eye worm) hypothetical protein 0.0071 0.0556 0.0748
Echinococcus multilocularis zinc finger protein 0.0019 0.0032 0.0034
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0087 0.0152
Loa Loa (eye worm) hypothetical protein 0.0126 0.1108 0.1501
Plasmodium falciparum endoplasmin, putative 0.0019 0.0036 0.0041
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0014 0.0008
Echinococcus multilocularis RUN 0.0019 0.0034 0.0036
Schistosoma mansoni heat shock protein 0.0032 0.0159 0.0206
Loa Loa (eye worm) hypothetical protein 0.0071 0.0556 0.0748
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0087 0.0023
Loa Loa (eye worm) carboxylesterase 0.0126 0.1108 0.1501
Trypanosoma brucei heat shock protein, putative 0.0032 0.0159 1
Echinococcus granulosus BC026374 protein S09 family 0.0126 0.1108 0.1501
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.27 1
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.015 0.135 0.183
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Brugia malayi Carboxylesterase family protein 0.0126 0.1108 0.1509
Brugia malayi Carboxylesterase family protein 0.0126 0.1108 0.1509
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0192 0.0252
Loa Loa (eye worm) acetylcholinesterase 1 0.0747 0.7343 1
Trypanosoma brucei heat shock protein 90, putative 0.0032 0.0159 1
Schistosoma mansoni amine oxidase 0.0071 0.0556 0.0748
Loa Loa (eye worm) carboxylesterase 0.0126 0.1108 0.1501
Loa Loa (eye worm) PHD-finger family protein 0.0028 0.0126 0.0161
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.27 1
Trichomonas vaginalis heat shock protein, putative 0.0025 0.0094 0.0218
Echinococcus multilocularis carboxylesterase 5A 0.0747 0.7343 1
Mycobacterium ulcerans protoporphyrinogen oxidase 0.0071 0.0556 0.0467
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0139 0.1238 0.1154
Echinococcus multilocularis microtubule associated protein 2 0.0672 0.6591 0.8976
Leishmania major hypothetical protein, conserved 0.0025 0.0087 0.0023
Brugia malayi jmjC domain containing protein 0.0024 0.0086 0.0118
Echinococcus granulosus zinc finger protein 0.0019 0.0032 0.0034
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Echinococcus multilocularis para nitrobenzyl esterase 0.0126 0.1108 0.1501
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0061 0.0073
Schistosoma mansoni jumonji/arid domain-containing protein 0.0094 0.078 0.1053
Trypanosoma brucei Heat shock protein 83, putative 0.0032 0.0159 1
Loa Loa (eye worm) doublecortin family protein 0.0019 0.0034 0.0036
Plasmodium falciparum lysine-specific histone demethylase 1, putative 0.0071 0.0556 1
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0126 0.1108 0.1104
Echinococcus multilocularis peregrin 0.0031 0.0149 0.0193
Brugia malayi Carboxylesterase family protein 0.0126 0.1108 0.1509
Schistosoma mansoni zinc finger protein 0.0019 0.0032 0.0034
Chlamydia trachomatis protoporphyrinogen oxidase 0.0071 0.0556 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0288 0.0383
Trichomonas vaginalis heat shock protein, putative 0.0025 0.0094 0.0218
Echinococcus multilocularis phd:f box containing protein 0.0024 0.0086 0.0107
Schistosoma mansoni rab6-interacting 0.0019 0.0034 0.0036
Brugia malayi jmjC domain containing protein 0.0024 0.0086 0.0118
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Brugia malayi Carboxylesterase family protein 0.0747 0.7343 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0024 0.0086 0.0107
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0288 0.0383
Onchocerca volvulus Alhambra homolog 0.0028 0.0126 0.0859
Echinococcus multilocularis jumonji domain containing 1A 0.0024 0.0086 0.0107
Schistosoma mansoni hypothetical protein 0.0019 0.0034 0.0036
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Echinococcus multilocularis heat shock protein 90 0.0025 0.0094 0.0118
Echinococcus granulosus Polycystic kidney disease protein 0.0019 0.0034 0.0036
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.1009 0.1365
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0288 0.0383
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0126 0.1108 0.1501
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0139 0.1238 0.1244
Brugia malayi hypothetical protein 0.0019 0.0034 0.0046
Loa Loa (eye worm) hypothetical protein 0.0126 0.1108 0.1501
Echinococcus granulosus acetylcholinesterase 0.0747 0.7343 1
Mycobacterium leprae PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO) 0.0071 0.0556 0.4042
Echinococcus granulosus heat shock protein 90 0.0025 0.0094 0.0118
Plasmodium falciparum protoporphyrinogen oxidase 0.0071 0.0556 1
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.0034 0.0036
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0025 0.0094 0.0164
Plasmodium falciparum JmjC domain-containing protein, putative 0.0024 0.0086 0.1007
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0087 0.1116
Loa Loa (eye worm) hypothetical protein 0.0024 0.0086 0.0107
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0024 0.0086 0.1095
Brugia malayi hypothetical protein 0.0019 0.0034 0.0046
Echinococcus granulosus para nitrobenzyl esterase 0.0126 0.1108 0.1501
Loa Loa (eye worm) hypothetical protein 0.0071 0.0556 0.0748
Brugia malayi jmjC domain containing protein 0.015 0.135 0.1839
Brugia malayi hypothetical protein 0.0126 0.1108 0.1509
Echinococcus granulosus neuroligin 0.0126 0.1108 0.1501
Echinococcus multilocularis BC026374 protein (S09 family) 0.0126 0.1108 0.1501
Loa Loa (eye worm) jmjC domain-containing protein 0.0024 0.0086 0.0107
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.1009 0.1365
Schistosoma mansoni lipoxygenase 0.0054 0.0381 0.0509
Plasmodium vivax endoplasmin, putative 0.0032 0.0159 0.2394
Echinococcus granulosus microtubule associated protein 2 0.0672 0.6591 0.8976
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0126 0.1108 0.1501
Trypanosoma cruzi heat shock protein 90, putative 0.0032 0.0159 0.2469
Schistosoma mansoni polycystin 1-related 0.0019 0.0034 0.0036
Treponema pallidum fructose-bisphosphate aldolase 0.0285 0.27 1
Plasmodium vivax hypothetical protein, conserved 0.0071 0.0556 1
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Trichomonas vaginalis heat shock protein, putative 0.0025 0.0094 0.0218
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Plasmodium vivax heat shock protein 86, putative 0.0032 0.0159 0.2394
Brugia malayi Carboxylesterase family protein 0.0126 0.1108 0.1509
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0024 0.0086 0.0107
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0061 0.0073
Brugia malayi jmjC domain containing protein 0.0094 0.078 0.1062
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0288 0.0383
Trypanosoma brucei heat shock protein, putative 0.0032 0.0159 1
Loa Loa (eye worm) hypothetical protein 0.0126 0.1108 0.1501
Brugia malayi Bromodomain containing protein 0.0037 0.0215 0.0293
Plasmodium vivax hypothetical protein, conserved 0.0071 0.0556 1
Toxoplasma gondii heat shock protein HSP90 0.0032 0.0159 0.1542
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.27 1
Schistosoma mansoni loxhd1 0.0019 0.0034 0.0036
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0087 0.1028
Trichomonas vaginalis heat shock protein, putative 0.0032 0.0159 0.0461
Echinococcus granulosus PHD finger protein rhinoceros 0.0028 0.0126 0.0161
Schistosoma mansoni BC026374 protein (S09 family) 0.0126 0.1108 0.1501
Brugia malayi Endoplasmin precursor 0.0032 0.0159 0.0216
Loa Loa (eye worm) hypothetical protein 0.0064 0.0483 0.0648
Trypanosoma cruzi heat shock protein 85, putative 0.0032 0.0159 0.2469
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0087 0.1028
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0288 0.0383
Schistosoma mansoni lipoxygenase 0.0019 0.0034 0.0036
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0285 0.27 1
Schistosoma mansoni neuroligin 3 (S09 family) 0.0126 0.1108 0.1501
Loa Loa (eye worm) hypothetical protein 0.0019 0.0034 0.0036
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.0034 0.0036
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0025 0.0094 0.0118
Echinococcus multilocularis heat shock protein 0.0032 0.0159 0.0206
Echinococcus multilocularis lysine specific demethylase 5A 0.0092 0.0761 0.1028
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Loa Loa (eye worm) hypothetical protein 0.0025 0.0087 0.0109
Brugia malayi Doublecortin family protein 0.0019 0.0034 0.0046
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0288 0.0383
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0126 0.1108 0.1501
Echinococcus multilocularis JmjC domain containing protein 4 0.0024 0.0086 0.0107
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0087 0.1028
Echinococcus multilocularis 0.0071 0.0556 0.0748
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.1012 1 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0086 0.0107
Echinococcus granulosus lysine specific demethylase 6a 0.0024 0.0086 0.0107
Brugia malayi jmjC domain containing protein 0.0024 0.0086 0.0118
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0061 0.0073
Schistosoma mansoni rab6-interacting 0.0019 0.0034 0.0036
Trypanosoma cruzi heat shock protein 85, putative 0.0032 0.0159 0.2469
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0288 0.0383
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.0034 0.0036
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.27 1
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0126 0.1108 0.1501
Leishmania major UDP-galactopyranose mutase 0.0071 0.0556 1
Echinococcus granulosus lysine specific demethylase 5A 0.0094 0.078 0.1053
Trichomonas vaginalis spcc417.12 protein, putative 0.0126 0.1108 0.4026
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0126 0.1108 0.1104
Onchocerca volvulus 0.0071 0.0556 0.4862
Loa Loa (eye worm) hypothetical protein 0.0071 0.0556 0.0748
Onchocerca volvulus 0.0126 0.1108 1
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Schistosoma mansoni hypothetical protein 0.002 0.0043 0.0048
Loa Loa (eye worm) hypothetical protein 0.0126 0.1108 0.1501
Schistosoma mansoni heat shock protein 0.0032 0.0159 0.0206
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0747 0.7343 1
Brugia malayi heat shock protein 90 0.0032 0.0159 0.0216
Loa Loa (eye worm) hypothetical protein 0.0037 0.0216 0.0284
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0139 0.1238 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0058 0.0425 0.0569
Mycobacterium tuberculosis Carboxylesterase LipT 0.0126 0.1108 0.1104
Echinococcus multilocularis jumonji domain containing protein 0.004 0.0238 0.0314
Schistosoma mansoni jumonji domain containing protein 0.0131 0.1158 0.1569
Trypanosoma cruzi UDP-galactopyranose mutase 0.0071 0.0556 1
Echinococcus multilocularis Polycystic kidney disease protein 0.0019 0.0034 0.0036
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0126 0.1108 0.4026
Echinococcus multilocularis acetylcholinesterase 0.0747 0.7343 1
Plasmodium falciparum heat shock protein 90 0.0032 0.0159 0.2394
Toxoplasma gondii heat shock protein 90, putative 0.0032 0.0159 0.1542
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 0.0025 0.0094 0.5
Trypanosoma brucei heat shock protein, putative 0.0032 0.0159 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.27 1
Echinococcus multilocularis lysine specific demethylase 6a 0.0024 0.0086 0.0107
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0024 0.0086 0.1095
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.27 1
Onchocerca volvulus 0.0126 0.1108 1
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Mycobacterium tuberculosis Possible oxidoreductase 0.0071 0.0556 0.0503
Loa Loa (eye worm) jmjC domain-containing protein 0.0059 0.043 0.0575
Schistosoma mansoni gliotactin 0.0126 0.1108 0.1501
Loa Loa (eye worm) hypothetical protein 0.0126 0.1108 0.1501
Schistosoma mansoni endoplasmin 0.0032 0.0159 0.0206
Schistosoma mansoni jumonji domain containing protein 0.0024 0.0086 0.0107
Loa Loa (eye worm) hypothetical protein 0.0042 0.0258 0.0341
Loa Loa (eye worm) heat shock protein 90 0.0032 0.0159 0.0206
Trypanosoma cruzi UDP-galactopyranose mutase 0.0071 0.0556 1
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0285 0.27 1
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0071 0.0556 0.0748
Brugia malayi MH2 domain containing protein 0.0116 0.1009 0.1374
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0288 0.0393
Mycobacterium ulcerans carboxylesterase, LipT 0.0126 0.1108 0.1024
Echinococcus granulosus endoplasmin 0.0025 0.0094 0.0118
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Trypanosoma brucei heat shock protein, putative 0.0032 0.0159 1
Giardia lamblia PHD finger protein 15 0.0028 0.0126 0.0123
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.0126 0.0845
Schistosoma mansoni amine oxidase 0.0071 0.0556 0.0748
Brugia malayi SWIRM domain containing protein 0.0071 0.0556 0.0758
Plasmodium vivax lysine-specific histone demethylase 1, putative 0.0071 0.0556 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0058 0.0425 0.0569
Brugia malayi Bromodomain containing protein 0.0073 0.0574 0.0782
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.0126 0.0845
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0026 0.0105 0.0133
Loa Loa (eye worm) hypothetical protein 0.0071 0.0556 0.0748
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.015 0.135 0.183
Brugia malayi PHD-finger family protein 0.0024 0.0085 0.0115
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.0034 0.0036
Trypanosoma cruzi heat shock protein 85, putative 0.0032 0.0159 0.2469
Trypanosoma brucei heat shock protein, putative 0.0032 0.0159 1
Echinococcus granulosus phd:f box containing protein 0.0024 0.0086 0.0107
Giardia lamblia Heat shock protein HSP 90-alpha 0.0032 0.0159 0.0248
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0087 0.1116
Echinococcus multilocularis endoplasmin 0.0025 0.0094 0.0118
Loa Loa (eye worm) jmjC domain-containing protein 0.0094 0.078 0.1053
Trypanosoma cruzi heat shock protein 90, putative 0.0025 0.0094 0.1242
Schistosoma mansoni phosphatidylserine receptor 0.0024 0.0086 0.0107
Loa Loa (eye worm) hypothetical protein 0.0126 0.1108 0.1501
Trypanosoma brucei heat shock protein 90, putative 0.0032 0.0159 1
Brugia malayi Carboxylesterase family protein 0.0747 0.7343 1
Echinococcus granulosus peregrin 0.0031 0.0149 0.0193
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0071 0.0556 0.0748
Plasmodium vivax hypothetical protein, conserved 0.0028 0.0126 0.1767
Brugia malayi jmjC domain containing protein 0.0024 0.0086 0.0118
Schistosoma mansoni hypothetical protein 0.0028 0.0126 0.0161
Loa Loa (eye worm) carboxylesterase 0.0747 0.7343 1
Schistosoma mansoni microtubule-associated protein tau 0.0672 0.6591 0.8976
Onchocerca volvulus 0.0126 0.1108 1
Trypanosoma brucei heat shock protein, putative 0.0032 0.0159 1
Brugia malayi PHD-finger family protein 0.0028 0.0126 0.0172
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.0071 0.0556 1
Trypanosoma cruzi Heat shock protein 83, putative 0.0032 0.0159 0.2469
Mycobacterium tuberculosis Conserved hypothetical protein 0.0071 0.0556 0.0503
Trypanosoma brucei heat shock protein, putative 0.0032 0.0159 1
Echinococcus multilocularis protoporphyrinogen oxidase 0.0071 0.0556 0.0748
Brugia malayi hypothetical protein 0.0071 0.0556 0.0758
Loa Loa (eye worm) hypothetical protein 0.0019 0.0034 0.0036
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0192 0.0252
Echinococcus granulosus heat shock protein 0.0032 0.0159 0.0206
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0126 0.1108 0.1501
Trypanosoma cruzi heat shock protein 85, putative 0.0025 0.0094 0.1242
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0054 0.0381 0.0509
Echinococcus multilocularis PHD finger protein rhinoceros 0.0028 0.0126 0.0161
Brugia malayi hypothetical protein 0.0025 0.0087 0.0119
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0288 0.0383
Loa Loa (eye worm) hypothetical protein 0.0028 0.0126 0.0161
Mycobacterium ulcerans oxidoreductase 0.0071 0.0556 0.0467
Echinococcus granulosus lysine specific histone demethylase 1A 0.0071 0.0556 0.0748
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.0071 0.0556 0.0748
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.0941 0.9285 1
Loa Loa (eye worm) endoplasmin 0.0032 0.0159 0.0206
Giardia lamblia Fructose-bisphosphate aldolase 0.0285 0.27 1
Schistosoma mansoni phd/f-box containing protein 0.0024 0.0086 0.0107
Echinococcus granulosus heat shock protein 90 0.0032 0.0159 0.0206
Loa Loa (eye worm) hypothetical protein 0.0747 0.7343 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.27 1
Echinococcus granulosus jumonji domain containing protein 0.004 0.0238 0.0314
Schistosoma mansoni endoplasmin 0.0032 0.0159 0.0206
Plasmodium falciparum phd finger protein, putative 0.0028 0.0126 0.1767
Brugia malayi Bromodomain containing protein 0.0031 0.0149 0.0203
Schistosoma mansoni acetylcholinesterase 0.0126 0.1108 0.1501
Echinococcus granulosus RUN 0.0019 0.0034 0.0036
Plasmodium vivax protoporphyrinogen oxidase, putative 0.0071 0.0556 1
Mycobacterium ulcerans dehydrogenase 0.0071 0.0556 0.0467
Plasmodium vivax JmjC domain containing protein 0.0024 0.0086 0.1007
Echinococcus granulosus acetylcholinesterase 0.0747 0.7343 1
Loa Loa (eye worm) hypothetical protein 0.0747 0.7343 1
Schistosoma mansoni bromodomain containing protein 0.0062 0.046 0.0617
Onchocerca volvulus 0.0126 0.1108 1
Loa Loa (eye worm) hypothetical protein 0.0069 0.0533 0.0716
Echinococcus granulosus carboxylesterase 5A 0.0747 0.7343 1
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0071 0.0556 1
Echinococcus multilocularis heat shock protein 90 0.0032 0.0159 0.0206
Toxoplasma gondii histone lysine-specific demethylase 0.0071 0.0556 1
Echinococcus granulosus lysine specific histone demethylase 1A 0.0071 0.0556 0.0748
Leishmania major heat shock protein 83-1 0.0032 0.0159 0.1542

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 25 ug ml-1 Antiinflammatory activity against TNF-alpha-induced ICAM1 protein expression in HUVEC pretreated for 2 hrs before TNFalpha challenge measured after 16 hrs by whole cell ELISA ChEMBL. 21955679
Inhibition (functional) = 90 % Antiinflammatory activity against TNF-alpha-induced ICAM1 protein expression in HUVEC at maximum tolerated dose pretreated for 2 hrs before TNFalpha challenge measured after 16 hrs by whole cell ELISA ChEMBL. 21955679
MTD (ADMET) = 50 ug ml-1 Cytotoxicity against HUVEC assessed as maximum tolerated dose for >95% cell viability after 24 hrs by MTT assay ChEMBL. 21955679

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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