Detailed information for compound 287405

Basic information

Technical information
  • TDR Targets ID: 287405
  • Name: 1-(3,4-dihydroxyphenyl)-2-methylpropan-1-one
  • MW: 180.2 | Formula: C10H12O3
  • H donors: 2 H acceptors: 3 LogP: 1.94 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(C(=O)c1ccc(c(c1)O)O)C
  • InChi: 1S/C10H12O3/c1-6(2)10(13)7-3-4-8(11)9(12)5-7/h3-6,11-12H,1-2H3
  • InChiKey: VDQLKIBLTMPAHI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-(3,4-dihydroxyphenyl)-2-methyl-propan-1-one
  • 1-(3,4-dihydroxyphenyl)-2-methyl-1-propanone
  • U 0521
  • 5466-89-7
  • 1-Propanone, 1-(3,4-dihydroxyphenyl)-2-methyl-
  • 3',4'-Dihydroxy-.alpha.-methylpropiophenone
  • 3',4'-Dihydroxy-2-methylpropiophenone
  • Isobutyrophenone, 3',4'-dihydroxy-
  • NSC27389
  • Propiophenone, 3',4'-dihydroxy-.alpha.-methyl-
  • Propiophenone, 3',4'-dihydroxy-2-methyl-
  • SMR000393746
  • MLS000738074
  • C15475
  • U-0521
  • 3',4'-Dihydroxy-alpha-methylpropiophenone
  • 3',4'-Dihydroxyisobutyrophenone
  • BRN 2093432
  • NSC 27389
  • Propiophenone, 3',4'-dihydroxy-2-methyl- (8CI)
  • Propiophenone, 3',4'-dihydroxy-alpha-methyl-
  • 1-Propanone, 1-(3,4-dihydroxyphenyl)-2-methyl- (9CI)

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens glucosidase, alpha Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Rattus norvegicus Catechol O-methyltransferase Starlite/ChEMBL References
Homo sapiens RecQ helicase-like Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Entamoeba histolytica recQ family DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Theileria parva hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) glycosyl hydrolase family 31 protein Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma mansoni DNA helicase recq5 Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei gambiense ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum ko:K01187 alpha-glucosidase [EC3.2.1.20], putative Get druggable targets OG5_127055 All targets in OG5_127055
Leishmania braziliensis ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Giardia lamblia Sgs1 DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi Glycosyl hydrolases family 31 protein Get druggable targets OG5_127055 All targets in OG5_127055
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans closely related to C. albicans GCA1 cell wall mannoprotein glycosyl hydrolase Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans potential catechol-O-methyltransferase Get druggable targets OG5_131164 All targets in OG5_131164
Mycobacterium ulcerans O-methyltransferase Get druggable targets OG5_131164 All targets in OG5_131164
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium yoelii ATP-dependent DNA helicase recQ-related Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Plasmodium berghei ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni alpha-glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans hypothetical protein Get druggable targets OG5_131164 All targets in OG5_131164
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans cell wall mannoprotein glycosyl hydrolase whose expression increases in presence of galatose Get druggable targets OG5_127055 All targets in OG5_127055
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans closely related to C. albicans GCA1 cell wall mannoprotein glycosyl hydrolase Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus multilocularis ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Mycobacterium tuberculosis Probable catechol-O-methyltransferase Get druggable targets OG5_131164 All targets in OG5_131164
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium parvum RecQ bloom helicase (RNA helicase+hrdc) Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni alpha-glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum Bloom syndrome protein homolog, putative Get druggable targets OG5_126644 All targets in OG5_126644
Onchocerca volvulus Get druggable targets OG5_127055 All targets in OG5_127055
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania infantum ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania donovani ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans cell wall mannoprotein glycosyl hydrolase whose expression increases in presence of galatose Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma mansoni DNA helicase recq1 Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) RecQ helicase Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium hominis DEAD/DEAH box helicase Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum Lysosomal alpha-glucosidase precursor, putative Get druggable targets OG5_127055 All targets in OG5_127055
Plasmodium yoelii ATP-dependent DNA helicase-related Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ADP-dependent DNA helicase RecQ Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K03654 ATP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Trichomonas vaginalis DNA helicase recq1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi Bloom's syndrome protein homolog Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Treponema pallidum ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Plasmodium falciparum ATP-dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni blooms syndrome DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Giardia lamblia U5 small nuclear ribonucleoprotein 200 kDa helicase, putative RecQ helicase-like 649 aa 521 aa 19.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0628 0.2037
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0024 0.0171 0.373
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0044 0.0459 0.1518
Brugia malayi Bloom's syndrome protein homolog 0.0024 0.0171 0.0425
Echinococcus granulosus neutral alpha glucosidase AB 0.0044 0.0459 0.1385
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0024 0.0171 0.5
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0024 0.0171 0.2801
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0628 0.2739
Trichomonas vaginalis DNA helicase recq, putative 0.0024 0.0171 0.2801
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0012 0.00000000014403 0.5
Schistosoma mansoni o-methyltransferase 0.0072 0.0878 0.383
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0701 0.2435
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0024 0.0171 0.0275
Schistosoma mansoni hypothetical protein 0.0019 0.01 0.0436
Loa Loa (eye worm) hypothetical protein 0.0072 0.0878 0.3109
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.01 0.0154
Schistosoma mansoni hypothetical protein 0.0041 0.0423 0.1842
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0628 0.2037
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0197 0.2693 1
Echinococcus granulosus bloom syndrome protein 0.0024 0.0171 0.0275
Brugia malayi O-methyltransferase 0.0072 0.0878 0.3109
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0024 0.0171 0.2801
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0024 0.0171 0.0425
Loa Loa (eye worm) hypothetical protein 0.0024 0.0171 0.0425
Trypanosoma cruzi hypothetical protein, conserved 0.0044 0.0459 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0016 0.0059 0.1291
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0044 0.0459 1
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0024 0.0171 0.5
Schistosoma mansoni o-methyltransferase 0.0072 0.0878 0.383
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0024 0.0171 0.0275
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0459 1
Loa Loa (eye worm) O-methyltransferase 0.0072 0.0878 0.3109
Trichomonas vaginalis maltase-glucoamylase, putative 0.0044 0.0459 1
Wolbachia endosymbiont of Brugia malayi O-methyltransferase 0.0072 0.0878 0.5
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0423 0.1379
Mycobacterium tuberculosis Probable catechol-O-methyltransferase 0.0625 0.8944 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0459 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0459 1
Trichomonas vaginalis DNA helicase recq, putative 0.0024 0.0171 0.2801
Leishmania major alpha glucosidase II subunit, putative 0.0044 0.0459 1
Echinococcus multilocularis bloom syndrome protein 0.0024 0.0171 0.0275
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0701 0.2435
Trichomonas vaginalis DNA helicase recq1, putative 0.0024 0.0171 0.2801
Brugia malayi O-methyltransferase family protein 0.0072 0.0878 0.3109
Echinococcus multilocularis neutral alpha glucosidase AB 0.0044 0.0459 0.1385
Schistosoma mansoni o-methyltransferase 0.0072 0.0878 0.383
Brugia malayi Latrophilin receptor protein 2 0.0019 0.01 0.0154
Loa Loa (eye worm) RecQ helicase 0.0024 0.0171 0.0425
Brugia malayi O-methyltransferase family protein 0.0072 0.0878 0.3109
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0044 0.0459 1
Schistosoma mansoni DNA helicase recq1 0.0024 0.0171 0.0747
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0459 1
Onchocerca volvulus 0.0072 0.0878 0.5754
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0628 0.2739
Schistosoma mansoni DNA helicase recq5 0.0024 0.0171 0.0747
Mycobacterium leprae PROBABLE METHYLTRANSFERASE 0.0072 0.0878 0.5
Schistosoma mansoni hypothetical protein 0.0019 0.01 0.0436
Schistosoma mansoni o-methyltransferase 0.0072 0.0878 0.383
Schistosoma mansoni alpha glucosidase 0.0044 0.0459 0.2002
Loa Loa (eye worm) hypothetical protein 0.006 0.0701 0.2435
Schistosoma mansoni alpha-glucosidase 0.0169 0.2294 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.01 0.0154
Trypanosoma cruzi hypothetical protein, conserved 0.0044 0.0459 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0628 0.2037
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0024 0.0171 0.0275
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0044 0.0459 1
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0024 0.0171 0.0275
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0044 0.0459 1
Trypanosoma brucei glucosidase, putative 0.0044 0.0459 1
Schistosoma mansoni alpha-glucosidase 0.0169 0.2294 1
Echinococcus multilocularis lysosomal alpha glucosidase 0.0197 0.2693 1
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0024 0.0171 0.0425
Echinococcus multilocularis lysosomal alpha glucosidase 0.0197 0.2693 1
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0024 0.0171 0.2801
Trichomonas vaginalis sucrase-isomaltase, putative 0.0044 0.0459 1
Brugia malayi O-methyltransferase family protein 0.0072 0.0878 0.3109
Onchocerca volvulus 0.0114 0.1483 1
Onchocerca volvulus 0.0072 0.0878 0.5754
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0628 0.216
Brugia malayi Glycosyl hydrolases family 31 protein 0.0044 0.0459 0.1518
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.01 0.0154
Echinococcus granulosus lysosomal alpha glucosidase 0.0197 0.2693 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0628 0.2739
Schistosoma mansoni hypothetical protein 0.0019 0.01 0.0436
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0024 0.0171 0.0425
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0459 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0423 0.1379
Entamoeba histolytica recQ family helicase, putative 0.0024 0.0171 0.373
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0628 0.2037
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0024 0.0171 0.373
Brugia malayi Glycosyl hydrolases family 31 protein 0.0197 0.2693 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0628 0.216
Schistosoma mansoni hypothetical protein 0.0019 0.01 0.0436
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0701 0.2435
Giardia lamblia Sgs1 DNA helicase, putative 0.0024 0.0171 0.5
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0044 0.0459 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 6000 nM In vitro inhibitory activity against catechol O-methyltransferase of rat brain using 3,4-dihydroxybenzoic acid as the substrate. ChEMBL. 2704029
IC50 (binding) = 6000 nM In vitro inhibitory activity against catechol O-methyltransferase of rat brain using 3,4-dihydroxybenzoic acid as the substrate. ChEMBL. 2704029
IC50 (binding) = 24000 nM Inhibitory activity against the tyrosine hydroxylase ChEMBL. 2704029
IC50 (binding) = 24000 nM Inhibitory activity against the tyrosine hydroxylase ChEMBL. 2704029
IC50 (binding) = 50000 nM Inhibitory activity against the dopamine beta hydroxylase ChEMBL. 2704029
IC50 (binding) = 50000 nM Inhibitory activity against the dopamine decarboxylase ChEMBL. 2704029
IC50 (binding) = 50000 nM Inhibitory activity against the Monoamine oxidase A ChEMBL. 2704029
IC50 (binding) = 50000 nM Inhibitory activity against the Monoamine oxidase B ChEMBL. 2704029
IC50 (binding) = 50000 nM Inhibitory activity against the dopamine beta hydroxylase ChEMBL. 2704029
IC50 (binding) = 50000 nM Inhibitory activity against the dopamine decarboxylase ChEMBL. 2704029
IC50 (binding) = 50000 nM Inhibitory activity against the Monoamine oxidase A ChEMBL. 2704029
IC50 (binding) = 50000 nM Inhibitory activity against the Monoamine oxidase B ChEMBL. 2704029
IC50 (functional) 30.9 uM PUBCHEM_BIOASSAY: Identification of SV40 T antigen inhibitors: A route to novel anti-viral reagents. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID1909, AID2102, AID2501, AID2615, AID2775, AID449729, AID485276, AID485288] ChEMBL. No reference
Potency (functional) 1.7783 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 7.0795 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1). (Class of assay: confirmatory) [Related pubchem assays: 594 (Rhodamine region spectral profiling screen), 593 (Fluorescein region spectral profiling screen), 2367 (Probe Development Summary for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1)), 2353 (qHTS Validation Assay for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1))] ChEMBL. No reference
Potency (functional) = 7.0795 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of Human alpha-Glucosidase Cleavage of Glycogen. (Class of assay: confirmatory) [Related pubchem assays: 1473, 1466 ] ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS for Inhibitors of Glutaminase (GLS). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) = 100 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (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.
 
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

2 literature references were collected for this gene.

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