Detailed information for compound 1426998

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 403.496 | Formula: C26H30NOP
  • H donors: 1 H acceptors: 1 LogP: 6.97 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCC(=C[C@H](c1ccccc1)NP(=O)(c1ccccc1)c1ccccc1)C
  • InChi: 1S/C26H30NOP/c1-3-4-14-22(2)21-26(23-15-8-5-9-16-23)27-29(28,24-17-10-6-11-18-24)25-19-12-7-13-20-25/h5-13,15-21,26H,3-4,14H2,1-2H3,(H,27,28)/t26-/m1/s1
  • InChiKey: ODYSAWYGZWJOPM-AREMUKBSSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cytochrome P450, family 3, subfamily A, polypeptide 4 Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references
Homo sapiens multiple endocrine neoplasia I No references
Homo sapiens thyroid stimulating hormone receptor Starlite/ChEMBL No references
Homo sapiens mitogen-activated protein kinase 1 Starlite/ChEMBL No references
Bacillus anthracis Anthrax lethal factor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania mexicana mitogen activated protein kinase, putative,map kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Trypanosoma cruzi mitogen activated protein kinase 2, putative Get druggable targets OG5_126781 All targets in OG5_126781
Giardia lamblia Kinase, CMGC MAPK Get druggable targets OG5_126781 All targets in OG5_126781
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Leishmania mexicana mitogen-activated protein kinase Get druggable targets OG5_126781 All targets in OG5_126781
Trypanosoma brucei gambiense cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania braziliensis mitogen activated protein kinase, putative,map kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus multilocularis mitogen activated protein kinase 3 Get druggable targets OG5_126781 All targets in OG5_126781
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 Get druggable targets OG5_126781 All targets in OG5_126781
Trypanosoma brucei protein kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Leishmania donovani cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans cytochrome P450 56 Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania mexicana cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans MAP kinase-like orf Get druggable targets OG5_126781 All targets in OG5_126781
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126781 All targets in OG5_126781
Trypanosoma brucei cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126781 All targets in OG5_126781
Trypanosoma congolense cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma japonicum ko:K04371 extracellular signal-regulated kinase 1/2, putative Get druggable targets OG5_126781 All targets in OG5_126781
Trypanosoma congolense tyrosine protein kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Candida albicans Serine/threonine protein kinase of MAP kinase family Get druggable targets OG5_126781 All targets in OG5_126781
Brugia malayi MAP kinase sur-1 Get druggable targets OG5_126781 All targets in OG5_126781
Loa Loa (eye worm) follicle stimulating hormone receptor Get druggable targets OG5_130089 All targets in OG5_130089
Leishmania infantum mitogen activated protein kinase, putative,map kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Leishmania major mitogen activated protein kinase, putative,map kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans MAP kinase implicated in PKC1-controlled signalling pathway Get druggable targets OG5_126781 All targets in OG5_126781
Leishmania infantum cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma cruzi cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania braziliensis cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma cruzi cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma cruzi mitogen activated protein kinase 4, putative Get druggable targets OG5_126781 All targets in OG5_126781
Leishmania infantum mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 Get druggable targets OG5_126781 All targets in OG5_126781
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Loa Loa (eye worm) CYP4Cod1 Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma cruzi mitogen-activated protein kinase 11, putative Get druggable targets OG5_126781 All targets in OG5_126781
Candida albicans cytochrome P450 556 Get druggable targets OG5_126554 All targets in OG5_126554
Echinococcus granulosus mitogen activated protein kinase 3 Get druggable targets OG5_126781 All targets in OG5_126781
Echinococcus granulosus mitogen activated protein kinase Get druggable targets OG5_126781 All targets in OG5_126781
Leishmania braziliensis mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440,map kinase Get druggable targets OG5_126781 All targets in OG5_126781
Trypanosoma cruzi mitogen-activated protein kinase 11, putative Get druggable targets OG5_126781 All targets in OG5_126781
Neospora caninum Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a Get druggable targets OG5_130642 All targets in OG5_130642
Candida albicans closely related to C.maltosa N-alkane-inducible cytochrome P-450, alkane hydroxylating monooxygenase CYP52A3-b aka P450Alk1A (BA Get druggable targets OG5_126554 All targets in OG5_126554
Cryptosporidium parvum MAPK, putative Get druggable targets OG5_126781 All targets in OG5_126781
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126781 All targets in OG5_126781
Trypanosoma brucei gambiense protein kinase, putative,tyrosine protein kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Candida albicans Serine/threonine protein kinase of MAP kinase family Get druggable targets OG5_126781 All targets in OG5_126781
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_126781 All targets in OG5_126781
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 Get druggable targets OG5_126781 All targets in OG5_126781
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma brucei gambiense mitogen-activated protein kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Schistosoma japonicum Mitogen-activated protein kinase 3, putative Get druggable targets OG5_126781 All targets in OG5_126781
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126554 All targets in OG5_126554
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase Get druggable targets OG5_126781 All targets in OG5_126781
Cryptosporidium hominis MAPK Get druggable targets OG5_126781 All targets in OG5_126781
Schistosoma japonicum Mitogen-activated protein kinase 3, putative Get druggable targets OG5_126781 All targets in OG5_126781
Candida albicans similar to C.maltosa N-alkane inducible cytochrome P-450, ALK8 CYP52A11 Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans similar to C.maltosa N-alkane inducible cytochrome P-450, ALK8 CYP52A11 Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
Leishmania donovani mitogen activated protein kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans MAP kinase-like orf Get druggable targets OG5_126781 All targets in OG5_126781
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Brugia malayi follicle stimulating hormone receptor Get druggable targets OG5_130089 All targets in OG5_130089
Leishmania major cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Echinococcus multilocularis mitogen activated protein kinase Get druggable targets OG5_126781 All targets in OG5_126781
Trypanosoma brucei mitogen activated protein kinase 4, putative Get druggable targets OG5_126781 All targets in OG5_126781
Leishmania donovani mitogen-activated protein kinase 4 Get druggable targets OG5_126781 All targets in OG5_126781
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126781 All targets in OG5_126781
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi cytochrome P450 cytochrome P450, family 3, subfamily A, polypeptide 4 502 aa 492 aa 24.2 %
Trypanosoma brucei mitogen-activated protein kinase 5 mitogen-activated protein kinase 1 360 aa 361 aa 33.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0019 0.0043 0.0036
Schistosoma mansoni hypothetical protein 0.0019 0.0043 0.004
Leishmania major alpha glucosidase II subunit, putative 0.0044 0.0138 0.143
Trypanosoma cruzi glycerol-3-phosphate dehydrogenase (FAD-dependent), putative 0.0216 0.0806 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.0057 0.039
Brugia malayi Glycosyl hydrolases family 31 protein 0.0197 0.073 0.6926
Onchocerca volvulus Dimethylglycine dehydrogenase, mitochondrial homolog 0.0216 0.0806 1
Trypanosoma brucei FAD dependent oxidoreductase, putative 0.0216 0.0806 1
Onchocerca volvulus Pyruvate dehydrogenase phosphatase regulatory subunit, mitochondrial homolog 0.0216 0.0806 1
Trichomonas vaginalis sucrase-isomaltase, putative 0.0044 0.0138 0.667
Trichomonas vaginalis CMGC family protein kinase 0.0062 0.0207 1
Echinococcus granulosus mitogen activated protein kinase 3 0.0062 0.0207 0.109
Trichomonas vaginalis CMGC family protein kinase 0.0062 0.0207 1
Trypanosoma brucei glycosyl hydrolase-like protein 0.0016 0.0032 0.007
Schistosoma mansoni alpha glucosidase 0.0044 0.0138 0.0135
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0044 0.0138 0.667
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0043 0.0036
Mycobacterium ulcerans thiamine biosynthesis oxidoreductase ThiO 0.0216 0.0806 0.0781
Plasmodium vivax FAD-dependent glycerol-3-phosphate dehydrogenase, putative 0.0216 0.0806 1
Schistosoma mansoni serine/threonine protein kinase 0.0062 0.0207 0.0205
Trichomonas vaginalis alpha-glucosidase, putative 0.0016 0.0032 0.1565
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.0057 0.039
Giardia lamblia Glycerol-3-phosphate dehydrogenase 0.0216 0.0806 1
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.0527 0.052
Echinococcus multilocularis muscleblind protein 1 0.018 0.0667 0.3539
Entamoeba histolytica NAD(FAD)-dependent dehydrogenase, putative 0.0216 0.0806 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.0527 0.052
Brugia malayi cDNA sequence BC016226 0.0216 0.0806 0.7651
Echinococcus multilocularis muscleblind protein 0.018 0.0667 0.3539
Echinococcus multilocularis neutral alpha glucosidase AB 0.0044 0.0138 0.0722
Loa Loa (eye worm) hypothetical protein 0.0011 0.0011 0.0003
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0044 0.0138 0.137
Schistosoma mansoni cpg binding protein 0.0037 0.0111 0.0108
Chlamydia trachomatis D-amino acid dehydrogenase 0.0216 0.0806 0.5
Schistosoma mansoni d-amino acid oxidase 0.2595 1 1
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0023 0.0057 0.003
Echinococcus granulosus glycerol 3 phosphate dehydrogenase 0.0216 0.0806 0.428
Loa Loa (eye worm) hypothetical protein 0.0216 0.0806 0.0799
Echinococcus multilocularis glycerol 3 phosphate dehydrogenase 0.0216 0.0806 0.428
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0016 0.0032 0.1565
Schistosoma mansoni smad 0.001 0.0008 0.0005
Echinococcus multilocularis smad 0.001 0.0008 0.0025
Brugia malayi RE18450p 0.0216 0.0806 0.7651
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0062 0.0207 0.2317
Schistosoma mansoni alpha-glucosidase 0.0169 0.0624 0.0621
Trypanosoma cruzi glycerol-3-phosphate dehydrogenase (FAD-dependent), putative 0.0216 0.0806 1
Schistosoma mansoni ATP:guanidino kinase (Smc74) 0.0216 0.0806 0.0803
Echinococcus granulosus cpg binding protein 0.0037 0.0111 0.0578
Trypanosoma brucei electron transfer flavoprotein-ubiquinone oxidoreductase, putative 0.0216 0.0806 1
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.0057 0.039
Echinococcus multilocularis Smad4 0.001 0.0008 0.0025
Echinococcus multilocularis mitogen activated protein kinase 3 0.0062 0.0207 0.109
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0023 0.0057 0.0322
Trypanosoma cruzi hypothetical protein, conserved 0.0044 0.0138 0.143
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0197 0.073 0.0723
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0202 0.1867
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0202 0.1867
Trichomonas vaginalis CMGC family protein kinase 0.0062 0.0207 1
Trichomonas vaginalis CMGC family protein kinase 0.0062 0.0207 1
Echinococcus multilocularis dnaJ subfamily B 0.0494 0.1879 1
Schistosoma mansoni cpg binding protein 0.0035 0.0104 0.0101
Loa Loa (eye worm) hypothetical protein 0.018 0.0667 0.066
Trichomonas vaginalis maltase-glucoamylase, putative 0.0016 0.0032 0.1565
Mycobacterium leprae PROBABLE D-AMINO ACID OXIDASE AAO 0.2595 1 1
Schistosoma mansoni fad oxidoreductase 0.0216 0.0806 0.0803
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0138 0.667
Trypanosoma cruzi glycerol-3-phosphate dehydrogenase, putative 0.0216 0.0806 1
Entamoeba histolytica anaerobic glycerol-3-phosphate dehydrogenase subunit A, putative 0.0216 0.0806 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0016 0.0032 0.1565
Echinococcus multilocularis TGF beta signal transducer SmadC 0.001 0.0008 0.0025
Mycobacterium ulcerans D-amino acid oxidase Aao 0.0216 0.0806 0.0781
Schistosoma mansoni hypothetical protein 0.0041 0.0129 0.0126
Brugia malayi Muscleblind-like protein 0.018 0.0667 0.632
Echinococcus granulosus neutral alpha glucosidase AB 0.0044 0.0138 0.0722
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0254 0.0251
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0062 0.0207 0.2317
Trypanosoma brucei glycerol-3-phosphate dehydrogenase (FAD-dependent), putative 0.0216 0.0806 1
Trypanosoma cruzi Present in the outer mitochondrial membrane proteome 20 0.0216 0.0806 1
Loa Loa (eye worm) CYP4Cod1 0.0015 0.0027 0.0019
Brugia malayi CXXC zinc finger family protein 0.0035 0.0104 0.0921
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0062 0.0207 0.2317
Echinococcus multilocularis mothers against decapentaplegic 5 0.001 0.0008 0.0025
Schistosoma mansoni hypothetical protein 0.0019 0.0043 0.004
Echinococcus multilocularis mitogen activated protein kinase 0.0062 0.0207 0.109
Loa Loa (eye worm) hypothetical protein 0.0041 0.0129 0.0121
Schistosoma mansoni cpg binding protein 0.0037 0.0111 0.0108
Schistosoma mansoni fad oxidoreductase 0.0216 0.0806 0.0803
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0043 0.0342
Schistosoma mansoni ap endonuclease 0.0023 0.0057 0.0054
Mycobacterium ulcerans glycerol-3-phosphate dehydrogenase 0.0216 0.0806 0.0781
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0057 0.2767
Schistosoma mansoni TGF-beta signal transducer Smad2 0.001 0.0008 0.0005
Echinococcus multilocularis lysosomal alpha glucosidase 0.0197 0.073 0.3876
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0043 0.0215
Loa Loa (eye worm) cytochrome P450 family protein 0.0015 0.0027 0.0019
Schistosoma mansoni Smad4 0.001 0.0008 0.0005
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0044 0.0138 0.1082
Trypanosoma cruzi L-2-hydroxyglutarate dehydrogenase, mitochondrial, putative 0.0216 0.0806 1
Loa Loa (eye worm) hypothetical protein 0.0216 0.0806 0.0799
Giardia lamblia Kinase, CMGC MAPK 0.0062 0.0207 0.2005
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0057 0.005
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0138 0.667
Schistosoma mansoni hypothetical protein 0.0494 0.1879 0.1876
Echinococcus granulosus FAD dependent oxidoreductase domain containing protein 0.0216 0.0806 0.428
Mycobacterium tuberculosis Possible thiamine biosynthesis oxidoreductase ThiO 0.0216 0.0806 0.0822
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0062 0.0207 0.2317
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0043 0.0215
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0062 0.0207 0.2317
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0016 0.0032 0.007
Brugia malayi dimethylglycine dehydrogenase, mitochondrial precursor, putative 0.0216 0.0806 0.7651
Leishmania major glycerol-3-phosphate dehydrogenase-like protein 0.0216 0.0806 1
Trypanosoma brucei L-2-hydroxyglutarate dehydrogenase, mitochondrial, putative 0.0216 0.0806 1
Mycobacterium tuberculosis Probable D-amino acid oxidase Aao 0.2379 0.9164 1
Schistosoma mansoni glycerol-3-phosphate dehydrogenase 0.0216 0.0806 0.0803
Schistosoma mansoni hypothetical protein 0.0019 0.0043 0.004
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0057 0.5
Echinococcus granulosus geminin 0.0205 0.0761 0.4039
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0062 0.0207 0.2005
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0104 0.0096
Echinococcus multilocularis cpg binding protein 0.0037 0.0111 0.0578
Echinococcus multilocularis GPCR, family 2 0.0019 0.0043 0.0215
Echinococcus multilocularis geminin 0.0205 0.0761 0.4039
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0044 0.0138 0.0131
Loa Loa (eye worm) cytochrome P450 family protein 0.0015 0.0027 0.0019
Trichomonas vaginalis maltase-glucoamylase, putative 0.0044 0.0138 0.667
Loa Loa (eye worm) histone methyltransferase 0.0011 0.0011 0.0004
Loa Loa (eye worm) glycerol-3-phosphate dehydrogenase 0.0216 0.0806 0.0799
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0057 0.0478
Mycobacterium ulcerans D-amino acid oxidase Aao 0.2595 1 1
Echinococcus granulosus GPCR family 2 0.0019 0.0043 0.0215
Brugia malayi pyruvate dehydrogenase phosphatase regulatory subunit precursor 0.0216 0.0806 0.7651
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0138 0.667
Leishmania major glycosyl hydrolase-like protein 0.0016 0.0032 0.007
Schistosoma mansoni alpha-glucosidase 0.0169 0.0624 0.0621
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0044 0.0138 0.137
Leishmania major hypothetical protein, conserved 0.0216 0.0806 1
Trypanosoma cruzi FAD dependent oxidoreductase, putative 0.0216 0.0806 1
Onchocerca volvulus 0.0114 0.0409 0.4875
Brugia malayi Glycosyl hydrolases family 31 protein 0.0044 0.0138 0.1254
Schistosoma mansoni NAD dehydrogenase 0.0216 0.0806 0.0803
Toxoplasma gondii FAD-dependent glycerol-3-phosphate dehydrogenase 0.0216 0.0806 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.0057 0.5
Loa Loa (eye worm) follicle stimulating hormone receptor 0.028 0.1051 0.1044
Schistosoma mansoni smad1 5 8 and 0.001 0.0008 0.0005
Loa Loa (eye worm) hypothetical protein 0.018 0.0667 0.066
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0138 0.667
Trichomonas vaginalis alpha-glucosidase, putative 0.0016 0.0032 0.1565
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0202 0.0195
Trypanosoma brucei glycerol-3-phosphate dehydrogenase (FAD-dependent), mitochondrial 0.0216 0.0806 1
Plasmodium falciparum FAD-dependent glycerol-3-phosphate dehydrogenase, putative 0.0216 0.0806 1
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.0011 0.0029
Echinococcus granulosus mitogen activated protein kinase 0.0062 0.0207 0.109
Onchocerca volvulus 0.0035 0.0104 0.0921
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0062 0.0207 0.02
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0224 0.2221
Leishmania major hypothetical protein, conserved 0.0216 0.0806 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0044 0.0138 0.667
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0057 0.2767
Brugia malayi follicle stimulating hormone receptor 0.028 0.1051 1
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0043 0.0342
Schistosoma mansoni ap endonuclease 0.0023 0.0057 0.0054
Trichomonas vaginalis alpha-glucosidase, putative 0.0016 0.0032 0.1565
Echinococcus granulosus smad 0.001 0.0008 0.0025
Echinococcus multilocularis lysosomal alpha glucosidase 0.0197 0.073 0.3876
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0138 0.667
Brugia malayi MAP kinase sur-1 0.0062 0.0207 0.1916
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.0057 0.029
Schistosoma mansoni hypothetical protein 0.0205 0.0761 0.0758
Brugia malayi MH2 domain containing protein 0.0144 0.0527 0.4978
Trichomonas vaginalis alpha-glucosidase, putative 0.0016 0.0032 0.1565
Schistosoma mansoni hypothetical protein 0.0205 0.0761 0.0758
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0016 0.0032 0.1565
Mycobacterium ulcerans glycerol-3-phosphate dehydrogenase GlpD2 0.0216 0.0806 0.0781
Echinococcus granulosus dnaJ subfamily B 0.0494 0.1879 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.0057 0.029
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0011 0.0044
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0043 0.0215
Schistosoma mansoni smad1 5 8 and 0.001 0.0008 0.0005
Brugia malayi Cytochrome P450 family protein 0.0015 0.0027 0.0186
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0062 0.0207 0.2317
Loa Loa (eye worm) hypothetical protein 0.006 0.0202 0.0195
Echinococcus granulosus Smad4 0.001 0.0008 0.0025
Echinococcus granulosus TGF beta signal transducer SmadC 0.001 0.0008 0.0025
Trypanosoma cruzi L-2-hydroxyglutarate dehydrogenase, mitochondrial, putative 0.0216 0.0806 1
Brugia malayi Cytochrome P450 family protein 0.0015 0.0027 0.0186
Schistosoma mansoni smad1 5 8 and 0.001 0.0008 0.0005
Schistosoma mansoni hypothetical protein 0.0019 0.0043 0.004
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0011 0.0044
Onchocerca volvulus Putative fad oxidoreductase 0.0216 0.0806 1
Echinococcus granulosus lysosomal alpha glucosidase 0.0197 0.073 0.3876
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0016 0.0032 0.007
Brugia malayi Glycosyl hydrolases family 31 protein 0.0016 0.0032 0.0239
Echinococcus granulosus muscleblind protein 0.018 0.0667 0.3539
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.0057 0.039
Loa Loa (eye worm) hypothetical protein 0.0216 0.0806 0.0799
Trypanosoma brucei glucosidase, putative 0.0044 0.0138 0.143
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0129 0.1161
Echinococcus granulosus mothers against decapentaplegic 5 0.001 0.0008 0.0025
Toxoplasma gondii hypothetical protein 0.0216 0.0806 1
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0062 0.0207 0.2317
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0043 0.0215
Trypanosoma cruzi hypothetical protein, conserved 0.0044 0.0138 0.143
Echinococcus multilocularis FAD dependent oxidoreductase domain containing protein 0.0216 0.0806 0.428
Loa Loa (eye worm) hypothetical protein 0.0016 0.0032 0.0025
Trypanosoma brucei protein kinase, putative 0.0062 0.0207 0.2317

Activities

Activity type Activity value Assay description Source Reference
Potency (ADMET) = 2.5119 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Cytochrome P450 3A4. (Class of assay: confirmatory) [Related pubchem assays: 410 ] ChEMBL. No reference
Potency (ADMET) = 2.5119 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Substrates of Cytochrome P450 3A4. (Class of assay: confirmatory) [Related pubchem assays: 410 ] ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS Assay for Anthrax Lethal Toxin Internalization. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of the ERK Signaling Pathway using a Homogeneous Screening Assay; Stimulation with EGF. (Class of assay: confirmatory) [Related pubchem assays: 995 ] ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor: Activators of Intracellular cAMP Concentrations in Parental HEK 293. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Screen for Compounds that Selectively Target Cancer Cells with p53 Mutations: Cytotoxicity of p53ts Cells at the Nonpermissive Temperature. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of 15-hLO (15-human lipoxygenase). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Screen for Compounds that Selectively Target Cancer Cells with p53 Mutations: Cytotoxicity of p53ts Cells at the Permissive Temperature. (Class of assay: confirmatory) [Related pubchem assays: 902 ] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 39.8107 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] 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.
 
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

No literature references available for this target.

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