Detailed information for compound 18677

Basic information

Technical information
  • TDR Targets ID: 18677
  • Name: methyl (E)-3-(3,4-dimethoxyphenyl)prop-2-enoa te
  • MW: 222.237 | Formula: C12H14O4
  • H donors: 0 H acceptors: 1 LogP: 2.14 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)/C=C/c1ccc(c(c1)OC)OC
  • InChi: 1S/C12H14O4/c1-14-10-6-4-9(8-11(10)15-2)5-7-12(13)16-3/h4-8H,1-3H3/b7-5+
  • InChiKey: JXRYDOZRPYFBKO-FNORWQNLSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (E)-3-(3,4-dimethoxyphenyl)-2-propenoic acid methyl ester
  • (E)-3-(3,4-dimethoxyphenyl)acrylic acid methyl ester
  • methyl 3-(3,4-dimethoxyphenyl)prop-2-enoate
  • 3-(3,4-dimethoxyphenyl)prop-2-enoic acid methyl ester
  • (E)-3-(3,4-dimethoxyphenyl)prop-2-enoic acid methyl ester
  • 3-(3,4-dimethoxyphenyl)acrylic acid methyl ester
  • 5396-64-5
  • AI3-23964
  • Cinnamic acid, 3,4-dimethoxy-, methyl ester (8CI)
  • Methyl 3,4-dimethyoxycinnamate
  • NSC 4331
  • 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, methyl ester, trans
  • ARONIS002706
  • ZINC00243581
  • 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, methyl ester
  • 3,4-O-Dimethylcaffeic acid methyl ester
  • Cinnamic acid, 3,4-dimethoxy-, methyl ester
  • Methyl 3,4-dimethoxycinnamate
  • NSC4331
  • 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, methyl ester (9CI)
  • A1147/0053653

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 Glutamate receptor, ionotropic kainate 3 0.0138 0.089 0.5595
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.011 0.4894
Loa Loa (eye worm) hypothetical protein 0.0021 0.0075 0.0513
Mycobacterium tuberculosis Probable oxidoreductase 0.0098 0.0608 0.0817
Loa Loa (eye worm) hypothetical protein 0.0039 0.0202 0.1404
Echinococcus granulosus voltage dependent L type calcium channel subunit|voltage dependent calcium channel 0.0187 0.1224 0.77
Schistosoma mansoni cpg binding protein 0.0031 0.0146 0.1135
Schistosoma mansoni peroxidasin 0.0026 0.0111 0.0853
Onchocerca volvulus 0.0242 0.1605 1
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0012 0.0012 0.0059
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0147 0.1143
Loa Loa (eye worm) hypothetical protein 0.0021 0.0075 0.0513
Trypanosoma cruzi Voltage-dependent calcium channel subunit, putative 0.0114 0.0718 1
Loa Loa (eye worm) hypothetical protein 0.0021 0.0075 0.0513
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel|voltage dependent L type calcium channel subu 0.0187 0.1224 0.77
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0021 0.0075 0.0513
Echinococcus granulosus thioredoxin glutathione reductase 0.0039 0.0202 0.1259
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine 1-carboxyvinyltransferase MurA 0.1045 0.7162 1
Treponema pallidum amino acid ABC transporter, periplasmic binding protein 0.0093 0.0575 0.0552
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0111 0.0771
Onchocerca volvulus 0.0023 0.0093 0.0116
Onchocerca volvulus Peroxidasin homolog 0.0026 0.0111 0.0236
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0134 0.0926
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0075 0.0461
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0038
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0075 0.0518
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0023 0.0093 0.0573
Schistosoma mansoni RAR-like nuclear receptor 0.0021 0.0075 0.0556
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0021 0.0075 0.0556
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0031 0.0147 0.091
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0111 0.0771
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0187 0.1224 0.77
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0021 0.0075 0.0513
Echinococcus multilocularis glutamate receptor 4 0.0124 0.0791 0.4975
Schistosoma mansoni hypothetical protein 0.0175 0.1143 0.9336
Trypanosoma cruzi trypanothione reductase, putative 0.0039 0.0198 0.2511
Schistosoma mansoni glutamate receptor kainate 0.0092 0.0568 0.4606
Loa Loa (eye worm) hypothetical protein 0.0156 0.1012 0.7084
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0013 0.0024 0.016
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.024 0.1668
Plasmodium vivax glutathione reductase, putative 0.0039 0.0198 1
Onchocerca volvulus Chorion peroxidase homolog 0.0026 0.0111 0.0236
Schistosoma mansoni tyrosine kinase 0.0023 0.0093 0.0702
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0111 0.0766
Echinococcus multilocularis glutamate receptor subunit protein glur 0.017 0.1106 0.6957
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.0079 0.048 0.3011
Echinococcus multilocularis atrial natriuretic peptide receptor 0.0023 0.0093 0.0573
Brugia malayi hypothetical protein 0.0023 0.0093 0.0643
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.024 0.1498
Toxoplasma gondii hypothetical protein 0.0034 0.017 0.0613
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0013 0.0024 0.0088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.024 0.1498
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0088 0.054 0.0722
Brugia malayi hypothetical protein 0.0011 0.0008 0.0044
Loa Loa (eye worm) hypothetical protein 0.0023 0.0093 0.0637
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.0023 0.0093 0.0637
Loa Loa (eye worm) hypothetical protein 0.0023 0.0093 0.0637
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0075 0.0518
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0187 0.1224 0.77
Loa Loa (eye worm) voltage-dependent calcium channel 0.0039 0.0202 0.1404
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Chlamydia trachomatis glutamine binding protein 0.0093 0.0575 0.0552
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0187 0.1224 0.77
Echinococcus granulosus nmda type glutamate receptor 0.0138 0.089 0.5595
Leishmania major trypanothione reductase 0.0039 0.0198 1
Echinococcus multilocularis geminin 0.0175 0.1143 0.7191
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.011 0.4894
Loa Loa (eye worm) thioredoxin reductase 0.0039 0.0198 0.1376
Loa Loa (eye worm) blistered cuticle protein 3 0.0026 0.0111 0.0766
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0021 0.0075 0.0518
Brugia malayi Pre-SET motif family protein 0.0031 0.0147 0.1018
Echinococcus multilocularis glutamate receptor 2 0.0216 0.1427 0.8984
Echinococcus multilocularis glutamate receptor ionotropic kainate 0.0045 0.0246 0.1539
Onchocerca volvulus 0.0031 0.0147 0.0466
Loa Loa (eye worm) glutamate receptor 2 0.0092 0.0568 0.3969
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0021 0.0075 0.0556
Trichomonas vaginalis set domain proteins, putative 0.0242 0.1605 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0075 0.0518
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.0023 0.0093 0.0637
Loa Loa (eye worm) hypothetical protein 0.0023 0.0093 0.0637
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0098 0.0608 0.0102
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0023 0.0093 0.0573
Onchocerca volvulus Peroxidase homolog 0.0026 0.0111 0.0236
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0038
Brugia malayi Glutamate receptor 2 precursor 0.0216 0.1427 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.024 0.1498
Onchocerca volvulus Peroxidase homolog 0.0026 0.0111 0.0236
Echinococcus multilocularis thioredoxin glutathione reductase 0.0039 0.0202 0.1259
Loa Loa (eye worm) hypothetical protein 0.0026 0.011 0.0752
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.024 0.191
Echinococcus granulosus voltage dependent calcium channel 0.0039 0.0202 0.1262
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0115 0.0729 0.4581
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.011 0.4894
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0029 0.0135 0.0834
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0021 0.0075 0.0461
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0021 0.0075 0.0513
Trichomonas vaginalis mercuric reductase, putative 0.0013 0.0024 0.0152
Trypanosoma cruzi extracellular receptor, putative 0.0023 0.0093 0.0992
Toxoplasma gondii histone lysine methyltransferase SET1 0.0056 0.0323 0.1166
Echinococcus multilocularis voltage dependent calcium channel 0.0187 0.1224 0.77
Brugia malayi hypothetical protein 0.0026 0.011 0.0758
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.011 0.1229
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0021 0.0075 0.0556
Echinococcus granulosus metabotropic glutamate receptor 5 0.0023 0.0093 0.0573
Onchocerca volvulus 0.0029 0.0134 0.0385
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0021 0.0075 0.0513
Echinococcus multilocularis thyroid hormone receptor alpha 0.0021 0.0075 0.0461
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Loa Loa (eye worm) RGC/RGC protein kinase 0.0023 0.0093 0.0637
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0013 0.0024 0.0139
Entamoeba histolytica hypothetical protein 0.0023 0.0093 0.5
Toxoplasma gondii NADPH-glutathione reductase 0.0013 0.0024 0.0088
Echinococcus granulosus atrial natriuretic peptide receptor 0.0023 0.0093 0.0573
Schistosoma mansoni glutamate receptor AMPA 0.0092 0.0568 0.4606
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0021 0.0075 0.0461
Brugia malayi hypothetical protein 0.0156 0.1012 0.7086
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0075 0.0518
Mycobacterium leprae PROBABLE UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE MURA 0.1045 0.7162 1
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.011 0.0395
Trypanosoma brucei trypanothione reductase 0.0039 0.0198 0.2511
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Leishmania major hypothetical protein, conserved 0.0026 0.011 0.4894
Brugia malayi Nuclear hormone receptor-like 1 0.0021 0.0075 0.0518
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0115 0.0729 0.4581
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.024 0.191
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0011 0.0008 0.0034
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.0239 0.1588 1
Mycobacterium leprae probable 3-phosphoshikimate 1-carboxyvinyl transferase AroA (5-ENOLPYRUVYLSHIKIMATE-3-PHOSPHATE SYNTHASE) (EPSP SYNTHASE) (EPSPS 0.041 0.277 0.3368
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0021 0.0075 0.0461
Brugia malayi hypothetical protein 0.0011 0.0008 0.0044
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0088 0.054 0.0722
Brugia malayi nuclear receptor RXR 0.0011 0.0008 0.0044
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0115 0.0729 0.4581
Toxoplasma gondii transporter, cation channel family protein 0.0039 0.0202 0.0731
Plasmodium vivax thioredoxin reductase, putative 0.0039 0.0198 1
Echinococcus multilocularis sodium channel protein 0.0079 0.048 0.3011
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.011 0.1229
Mycobacterium ulcerans UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1455 1 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0039 0.0198 0.0244
Echinococcus granulosus Ribosomal protein S1 RNA binding domain 0.0045 0.0246 0.1539
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.0147 0.091
Brugia malayi Receptor family ligand binding region containing protein 0.0023 0.0093 0.0643
Brugia malayi Receptor family ligand binding region containing protein 0.0023 0.0093 0.0643
Loa Loa (eye worm) hypothetical protein 0.0023 0.0093 0.0637
Echinococcus multilocularis cpg binding protein 0.0031 0.0146 0.0905
Echinococcus multilocularis Ribosomal protein S1, RNA binding domain 0.0045 0.0246 0.1539
Treponema pallidum UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1455 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.024 0.1672
Mycobacterium tuberculosis Probable reductase 0.0088 0.054 0.0722
Echinococcus multilocularis glutamate receptor 2 0.0194 0.1274 0.8018
Brugia malayi nuclear hormone receptor 0.0021 0.0075 0.0518
Brugia malayi hypothetical protein 0.0026 0.0111 0.0771
Schistosoma mansoni peroxidasin 0.0026 0.0111 0.0853
Echinococcus multilocularis glutamate receptor 2 0.0239 0.1588 1
Echinococcus multilocularis voltage dependent calcium channel 0.0187 0.1224 0.77
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.0147 0.1143
Brugia malayi Metabotropic glutamate receptor precursor. 0.0023 0.0093 0.0643
Echinococcus granulosus receptor type guanylyl cyclase 0.0023 0.0093 0.0573
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Brugia malayi steroid hormone receptor 0.0021 0.0075 0.0518
Echinococcus granulosus glutamate receptor subunit protein glur 0.017 0.1106 0.6957
Schistosoma mansoni thyroid hormone receptor 0.0021 0.0075 0.0556
Loa Loa (eye worm) metabotropic glutamate receptor 8 0.0023 0.0093 0.0637
Schistosoma mansoni hypothetical protein 0.0045 0.0246 0.1962
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0021 0.0075 0.0513
Loa Loa (eye worm) hypothetical protein 0.0023 0.0093 0.0637
Echinococcus granulosus glutamate receptor 4 0.0124 0.0791 0.4975
Schistosoma mansoni coup transcription factor 0.0021 0.0075 0.0556
Treponema pallidum amino acid ABC transporter, periplasmic binding protein (hisJ) 0.0093 0.0575 0.0552
Onchocerca volvulus Dual oxidase homolog 0.0026 0.0111 0.0236
Chlamydia trachomatis arginine ABC transporter substrate-binding protein ArtJ 0.0093 0.0575 0.0552
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Schistosoma mansoni high voltage-activated calcium channel Cav2A 0.0187 0.1224 1
Echinococcus granulosus glutamate receptor 2 0.0194 0.1274 0.8018
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0008 0.0044
Mycobacterium tuberculosis Probable glutamine-binding lipoprotein GlnH (GLNBP) 0.0093 0.0575 0.0772
Brugia malayi Peroxidasin 0.0026 0.0111 0.0771
Giardia lamblia NADH oxidase lateral transfer candidate 0.0013 0.0024 1
Toxoplasma gondii shikimate dehydrogenase substrate binding domain-containing protein 0.041 0.277 1
Brugia malayi CXXC zinc finger family protein 0.0029 0.0134 0.0931
Echinococcus granulosus glutamate receptor 2 0.0239 0.1588 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0075 0.0518
Brugia malayi Thioredoxin reductase 0.0039 0.0198 0.1381
Echinococcus multilocularis nmda type glutamate receptor 0.0138 0.089 0.5595
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0031 0.0147 0.053
Loa Loa (eye worm) hypothetical protein 0.0021 0.0075 0.0513
Brugia malayi Guanylyl cyclase protein 23 0.0023 0.0093 0.0643
Echinococcus multilocularis FTZ F1 alpha 0.0021 0.0075 0.0461
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0021 0.0075 0.0518
Echinococcus granulosus glutamate receptor ionotropic kainate 0.0045 0.0246 0.1539
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.011 0.1229
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0021 0.0075 0.0461
Brugia malayi Blistered cuticle protein 3 0.0026 0.0111 0.0771
Echinococcus granulosus glutamate receptor ionotropic kainate 3 0.0045 0.0246 0.1539
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0115 0.0729 0.4581
Loa Loa (eye worm) RGC/RGC protein kinase 0.0023 0.0093 0.0637
Loa Loa (eye worm) hypothetical protein 0.0034 0.017 0.1176
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0021 0.0075 0.0461
Mycobacterium tuberculosis Probable dehydrogenase 0.0088 0.054 0.0722
Loa Loa (eye worm) calcium channel 0.0187 0.1224 0.8571
Echinococcus multilocularis ecdysone induced protein 78C 0.0021 0.0075 0.0461
Schistosoma mansoni ATP-binding cassette transporter 0.0092 0.0568 0.4606
Trypanosoma brucei Voltage-dependent calcium channel subunit, putative 0.0114 0.0718 1
Schistosoma mansoni cpg binding protein 0.0029 0.0134 0.1041
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0021 0.0075 0.0518
Toxoplasma gondii thioredoxin reductase 0.0039 0.0198 0.0716
Schistosoma mansoni voltage-gated cation channel 0.0187 0.1224 1
Echinococcus multilocularis receptor type guanylyl cyclase 0.0023 0.0093 0.0573
Plasmodium vivax SET domain protein, putative 0.0031 0.0147 0.7027
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0088 0.054 0.0722
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0021 0.0075 0.0556
Echinococcus granulosus geminin 0.0175 0.1143 0.7191
Echinococcus multilocularis nmda type glutamate receptor 0.0023 0.0093 0.0573
Brugia malayi nuclear receptor NHR-88 0.0021 0.0075 0.0518
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0021 0.0075 0.0461
Loa Loa (eye worm) hypothetical protein 0.0023 0.0093 0.0637
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0111 0.0771
Mycobacterium ulcerans 3-phosphoshikimate 1-carboxyvinyltransferase 0.041 0.277 0.2753
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0038
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0021 0.0075 0.0518
Echinococcus granulosus cpg binding protein 0.0031 0.0146 0.0905
Loa Loa (eye worm) hypothetical protein 0.0023 0.0093 0.0637
Brugia malayi photoreceptor-specific nuclear receptor 0.0021 0.0075 0.0518
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0115 0.0729 0.4581
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.024 0.1498
Loa Loa (eye worm) hypothetical protein 0.0187 0.1224 0.8571
Brugia malayi hypothetical protein 0.0017 0.0047 0.0316
Brugia malayi metabotropic GABA-B receptor subtype 2 0.0023 0.0093 0.0643
Chlamydia trachomatis phosphoshikimate 1-carboxyl vinyltransferase 0.041 0.277 0.2753
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0088 0.054 0.0722
Schistosoma mansoni metabotropic glutamate receptor 0.0023 0.0093 0.0702
Brugia malayi Glutamate receptor 1 precursor 0.0216 0.1427 1
Schistosoma mansoni high voltage-activated calcium channel Cav1 0.0187 0.1224 1
Leishmania major extracellular receptor, putative 0.0023 0.0093 0.3952
Loa Loa (eye worm) steroid hormone receptor 0.0021 0.0075 0.0513
Echinococcus multilocularis glutamate (NMDA) receptor subunit 0.0092 0.0568 0.3565
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0013 0.0024 0.0139
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0075 0.0461
Loa Loa (eye worm) hypothetical protein 0.0124 0.0791 0.5538
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0111 0.0766
Echinococcus granulosus nmda type glutamate receptor 0.0023 0.0093 0.0573
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0021 0.0075 0.0556
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0021 0.0075 0.0461
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0013 0.0024 0.0136
Brugia malayi metabotropic glutamate receptor type 2 0.0023 0.0093 0.0643
Loa Loa (eye worm) hypothetical protein 0.0021 0.0075 0.0513
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel alpha 1 0.0187 0.1224 0.77
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0063 0.0369 0.2969
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0098 0.0608 0.0817
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0098 0.0608 0.0817
Onchocerca volvulus 0.0156 0.1012 0.6122
Schistosoma mansoni glutamate receptor kainate 0.0092 0.0568 0.4606
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0075 0.0461
Schistosoma mansoni glutamate receptor NMDA 0.0092 0.0568 0.4606
Mycobacterium ulcerans glutamine-binding lipoprotein GlnH 0.0093 0.0575 0.0552
Loa Loa (eye worm) glutamate receptor 1 0.0216 0.1427 1
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0111 0.0766
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0038
Loa Loa (eye worm) hypothetical protein 0.0034 0.017 0.1176
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0075 0.0461
Onchocerca volvulus Peroxidasin homolog 0.0026 0.0111 0.0236
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Schistosoma mansoni nuclear hormone receptor 0.0021 0.0075 0.0556
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0021 0.0075 0.0518
Echinococcus multilocularis tyrosine kinase 0.0023 0.0093 0.0573
Schistosoma mansoni retinoic acid receptor RXR 0.0021 0.0075 0.0556
Brugia malayi Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog 0.0187 0.1224 0.8572
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0021 0.0075 0.0513
Schistosoma mansoni glutamate receptor NMDA 0.0115 0.0729 0.5932
Echinococcus granulosus histone lysine methyltransferase setb 0.0031 0.0147 0.091
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Echinococcus granulosus glutamate NMDA receptor subunit 0.0092 0.0568 0.3565
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0011 0.0008 0.0034
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.0239 0.1588 1
Loa Loa (eye worm) hypothetical protein 0.0124 0.0791 0.5538
Brugia malayi glutathione reductase 0.0039 0.0198 0.1381
Loa Loa (eye worm) RGC/RGC protein kinase 0.0023 0.0093 0.0637
Loa Loa (eye worm) glutathione reductase 0.0039 0.0198 0.1376
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0008 0.0044
Schistosoma mansoni tyrosine kinase 0.0023 0.0093 0.0702
Echinococcus granulosus FTZ F1 alpha 0.0021 0.0075 0.0461
Onchocerca volvulus Atrial natriuretic peptide receptor 3 homolog 0.0023 0.0093 0.0116
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0021 0.0075 0.0461
Loa Loa (eye worm) hypothetical protein 0.0021 0.0075 0.0513
Echinococcus granulosus tyrosine kinase 0.0023 0.0093 0.0573
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0147 0.1143
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0111 0.0771
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0021 0.0075 0.0518
Plasmodium falciparum glutathione reductase 0.0039 0.0198 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Trichomonas vaginalis glutathione reductase, putative 0.0013 0.0024 0.0152
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0212 0.1402 0.9825
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0011 0.0008 0.0038
Loa Loa (eye worm) hypothetical protein 0.0021 0.0075 0.0513
Schistosoma mansoni thyroid hormone receptor 0.0021 0.0075 0.0556
Echinococcus granulosus voltage dependent calcium channel 0.0187 0.1224 0.77
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0111 0.0771
Schistosoma mansoni glutamate receptor AMPA 0.0092 0.0568 0.4606
Loa Loa (eye worm) glutamate receptor 0.0023 0.0093 0.0637
Onchocerca volvulus 0.0026 0.0111 0.0236
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0012 0.0012 0.0059
Loa Loa (eye worm) hypothetical protein 0.0031 0.0147 0.1013
Brugia malayi Steroid receptor seven-up type 2 0.0021 0.0075 0.0518
Loa Loa (eye worm) hypothetical protein 0.0023 0.0093 0.0637
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0021 0.0075 0.0513
Echinococcus granulosus glutamate receptor 1 0.0124 0.0791 0.4975
Loa Loa (eye worm) hypothetical protein 0.0011 0.0008 0.0038
Plasmodium falciparum thioredoxin reductase 0.0039 0.0198 1
Onchocerca volvulus 0.0023 0.0093 0.0116
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0021 0.0075 0.0461
Brugia malayi ecdysteroid receptor 0.0021 0.0075 0.0518
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0021 0.0075 0.0518
Wolbachia endosymbiont of Brugia malayi UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1455 1 1
Loa Loa (eye worm) hypothetical protein 0.0021 0.0075 0.0513
Echinococcus multilocularis NMDA receptor 0.0045 0.0246 0.1539
Brugia malayi Pre-SET motif family protein 0.0212 0.1402 0.9825
Echinococcus multilocularis peroxidasin 0.0026 0.0111 0.0688
Echinococcus granulosus metabotropic glutamate receptor 2 0.0023 0.0093 0.0573
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0111 0.0766
Schistosoma mansoni metabotropic glutamate receptor 0.0023 0.0093 0.0702
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0115 0.0729 0.4581
Onchocerca volvulus 0.0026 0.0111 0.0236
Schistosoma mansoni glutamate receptor kainate 0.0092 0.0568 0.4606
Schistosoma mansoni cpg binding protein 0.0031 0.0146 0.1135
Schistosoma mansoni steroid hormone receptor ad4bp 0.0021 0.0075 0.0556
Echinococcus granulosus peroxidasin 0.0026 0.0111 0.0688
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0075 0.0518
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.024 0.191
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0147 0.1143
Schistosoma mansoni hypothetical protein 0.0175 0.1143 0.9336
Onchocerca volvulus 0.0026 0.0111 0.0236
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0021 0.0075 0.0556
Schistosoma mansoni hypothetical protein 0.0012 0.0012 0.0032
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0187 0.1224 0.77
Loa Loa (eye worm) hypothetical protein 0.0124 0.0791 0.5538
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0766
Loa Loa (eye worm) hypothetical protein 0.0023 0.0093 0.0637
Schistosoma mansoni protein kinase 0.0023 0.0093 0.0702
Echinococcus granulosus ecdysone induced protein 78C 0.0021 0.0075 0.0461

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) > 30 ug ml-1 Inhibitory concentration against B16 murine melanoma cell line ChEMBL. 11354370
IC50 (functional) > 30 ug ml-1 Inhibitory concentration against HCT 116 human colon cancer cell line ChEMBL. 11354370
IC50 (functional) > 30 ug ml-1 Inhibitory concentration required against A 431 human epidermoid carcinoma cell line ChEMBL. 11354370
IC50 (functional) > 30 ug ml-1 Inhibitory concentration against B16 murine melanoma cell line ChEMBL. 11354370
IC50 (functional) > 30 ug ml-1 Inhibitory concentration against HCT 116 human colon cancer cell line ChEMBL. 11354370
IC50 (functional) > 30 ug ml-1 Inhibitory concentration required against A 431 human epidermoid carcinoma cell line ChEMBL. 11354370

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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