Detailed information for compound 1326288

Basic information

Technical information
  • TDR Targets ID: 1326288
  • Name: (E)-3-(5-tert-butylthiophen-2-yl)prop-2-enoic acid
  • MW: 210.293 | Formula: C11H14O2S
  • H donors: 1 H acceptors: 2 LogP: 3.3 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)/C=C/c1ccc(s1)C(C)(C)C
  • InChi: 1S/C11H14O2S/c1-11(2,3)9-6-4-8(14-9)5-7-10(12)13/h4-7H,1-3H3,(H,12,13)/b7-5+
  • InChiKey: KCFFSJPREHZTIM-FNORWQNLSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-(5-tert-butylthiophen-2-yl)prop-2-enoic acid
  • 3-(5-tert-butyl-2-thienyl)prop-2-enoic acid
  • (E)-3-(5-tert-butyl-2-thienyl)prop-2-enoic acid
  • (E)-3-(5-tert-butyl-2-thienyl)acrylic acid
  • 3-(5-tert-butyl-2-thienyl)acrylic acid
  • (2E)-3-(5-tert-butylthien-2-yl)acrylic acid
  • MLS000685503
  • SMR000312467
  • IFLab1_001093
  • IDI1_008960

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens mitogen-activated protein kinase 1 Starlite/ChEMBL No references
Homo sapiens polymerase (DNA directed) iota Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus mitogen activated protein kinase 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 mitogen activated protein kinase 4, putative Get druggable targets OG5_126781 All targets in OG5_126781
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Candida albicans MAP kinase-like orf Get druggable targets OG5_126781 All targets in OG5_126781
Cryptosporidium parvum MAPK, putative Get druggable targets OG5_126781 All targets in OG5_126781
Leishmania mexicana mitogen activated protein kinase, putative,map 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
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis mitogen activated protein kinase 3 Get druggable targets OG5_126781 All targets in OG5_126781
Leishmania braziliensis mitogen activated protein kinase, putative,map kinase, 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
Trypanosoma brucei gambiense mitogen-activated protein kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma brucei protein kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
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
Leishmania infantum mitogen activated protein kinase, putative,map kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Trypanosoma cruzi mitogen activated protein kinase 4, putative Get druggable targets OG5_126781 All targets in OG5_126781
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus mitogen activated protein kinase 3 Get druggable targets OG5_126781 All targets in OG5_126781
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania mexicana 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
Trichomonas vaginalis CMGC family protein kinase 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
Cryptosporidium hominis MAPK 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
Candida albicans Serine/threonine protein kinase of MAP kinase family Get druggable targets OG5_126781 All targets in OG5_126781
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi MAP kinase sur-1 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
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 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
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
Candida albicans MAP kinase-like orf Get druggable targets OG5_126781 All targets in OG5_126781
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 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
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 mitogen activated protein kinase Get druggable targets OG5_126781 All targets in OG5_126781
Schistosoma japonicum ko:K04371 extracellular signal-regulated kinase 1/2, putative 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
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Trypanosoma congolense tyrosine protein 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
Candida albicans Serine/threonine protein kinase of MAP kinase family Get druggable targets OG5_126781 All targets in OG5_126781
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma brucei gambiense protein kinase, putative,tyrosine protein 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
Schistosoma japonicum Mitogen-activated protein kinase 3, putative 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
Trypanosoma cruzi mitogen-activated protein kinase 11, putative Get druggable targets OG5_126781 All targets in OG5_126781
Leishmania donovani mitogen activated protein kinase, putative Get druggable targets OG5_126781 All targets in OG5_126781
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Candida albicans MAP kinase implicated in PKC1-controlled signalling pathway 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
Trypanosoma brucei mitogen-activated protein kinase 5 mitogen-activated protein kinase 1 360 aa 361 aa 33.2 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis mitogen activated protein kinase 3 0.0062 0.784 0.7673
Brugia malayi nuclear receptor NHR-88 0.0012 0.0718 0.0718
Loa Loa (eye worm) hypothetical protein 0.0012 0.0718 0.0718
Trichomonas vaginalis CMGC family protein kinase 0.0062 0.784 1
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0718 0.0718
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.6931 0.6931
Echinococcus multilocularis mitogen activated protein kinase 0.0062 0.784 0.7673
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.6931 0.6693
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0718 0.0718
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 1 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0718 0.0718
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0012 0.0718 0.0718
Brugia malayi steroid hormone receptor 0.0012 0.0718 0.0718
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.232 0.296
Loa Loa (eye worm) hypothetical protein 0.0012 0.0718 0.0718
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0012 0.0718 0.0718
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0012 0.0718 0.0718
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.6931 0.6931
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0718 0.0718
Loa Loa (eye worm) hypothetical protein 0.0012 0.0718 0.0718
Trypanosoma brucei protein kinase, putative 0.0062 0.784 1
Schistosoma mansoni terminal deoxycytidyl transferase 0.0023 0.232 0.232
Trypanosoma brucei unspecified product 0.0016 0.1276 0.1628
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.232 0.296
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.232 0.296
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0023 0.232 0.1727
Brugia malayi photoreceptor-specific nuclear receptor 0.0012 0.0718 0.0718
Schistosoma mansoni retinoic acid receptor RXR 0.0012 0.0718 0.0718
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0012 0.0718 0.0718
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0012 0.0718 0.0718
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0718 0.0718
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0062 0.784 1
Schistosoma mansoni coup transcription factor 0.0012 0.0718 0.0718
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0012 0.0718 0.0718
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0012 0.0718 0.0718
Brugia malayi Steroid receptor seven-up type 2 0.0012 0.0718 0.0718
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0023 0.232 0.5
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.232 0.296
Echinococcus multilocularis dna polymerase kappa 0.0023 0.232 0.1727
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.232 0.296
Trypanosoma cruzi DNA polymerase eta, putative 0.0023 0.232 0.296
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.6931 0.6693
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0062 0.784 1
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.6931 0.6931
Giardia lamblia Kinase, CMGC MAPK 0.0062 0.784 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0012 0.0718 0.0718
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0012 0.0718 0.0718
Leishmania major DNA polymerase kappa, putative 0.0023 0.232 0.296
Echinococcus multilocularis dna polymerase eta 0.0023 0.232 0.1727
Loa Loa (eye worm) RNA binding protein 0.0076 1 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0012 0.0718 0.0718
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0012 0.0718 0.0718
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0012 0.0718 0.0718
Trypanosoma brucei unspecified product 0.0023 0.232 0.296
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0062 0.784 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.6931 0.6693
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.232 0.296
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.1276 0.1628
Loa Loa (eye worm) TAR-binding protein 0.0076 1 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.0012 0.0718 0.0718
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0023 0.232 0.296
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.232 0.296
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0062 0.784 1
Onchocerca volvulus Protein ultraspiracle homolog 0.0012 0.0718 0.5
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.232 0.232
Trichomonas vaginalis CMGC family protein kinase 0.0062 0.784 1
Echinococcus multilocularis tar DNA binding protein 0.0076 1 1
Echinococcus granulosus mitogen activated protein kinase 3 0.0062 0.784 0.7673
Trichomonas vaginalis CMGC family protein kinase 0.0062 0.784 1
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0062 0.784 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0012 0.0718 0.0718
Loa Loa (eye worm) hypothetical protein 0.0012 0.0718 0.0718
Brugia malayi Nuclear hormone receptor-like 1 0.0012 0.0718 0.0718
Giardia lamblia DINP protein human, muc B family 0.0023 0.232 0.296
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.1276 0.1628
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0012 0.0718 0.0718
Plasmodium vivax DNA repair protein REV1, putative 0.0007 0 0.5
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0012 0.0718 0.0718
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.232 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0012 0.0718 0.0718
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0718 0.0718
Onchocerca volvulus Bile acid receptor homolog 0.0012 0.0718 0.5
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0023 0.232 0.1727
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.232 0.296
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.1276 0.1628
Loa Loa (eye worm) hypothetical protein 0.0012 0.0718 0.0718
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0012 0.0718 0.0718
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.6931 0.6931
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0012 0.0718 0.0718
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.6931 0.6693
Schistosoma mansoni nuclear hormone receptor 0.0012 0.0718 0.0718
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.232 0.296
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Echinococcus granulosus dna polymerase kappa 0.0023 0.232 0.1727
Echinococcus granulosus tar DNA binding protein 0.0076 1 1
Trypanosoma brucei unspecified product 0.0016 0.1276 0.1628
Loa Loa (eye worm) hypothetical protein 0.0012 0.0718 0.0718
Echinococcus granulosus dna polymerase eta 0.0023 0.232 0.1727
Entamoeba histolytica deoxycytidyl transferase, putative 0.0023 0.232 0.5
Loa Loa (eye worm) steroid hormone receptor 0.0012 0.0718 0.0718
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.232 0.296
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.232 1
Trypanosoma brucei DNA polymerase eta, putative 0.0023 0.232 0.296
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.232 0.296
Plasmodium falciparum DNA repair protein REV1, putative 0.0007 0 0.5
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0023 0.232 0.232
Loa Loa (eye worm) hypothetical protein 0.0012 0.0718 0.0718
Brugia malayi TAR-binding protein 0.0076 1 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0012 0.0718 0.0718
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0062 0.784 0.784
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.232 0.296
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0718 0.0718
Leishmania major DNA polymerase eta, putative 0.0023 0.232 0.296
Echinococcus granulosus mitogen activated protein kinase 0.0062 0.784 0.7673
Trichomonas vaginalis CMGC family protein kinase 0.0062 0.784 1
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.232 0.232
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.6931 0.6931
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.232 0.296
Loa Loa (eye worm) hypothetical protein 0.0023 0.232 0.232
Schistosoma mansoni serine/threonine protein kinase 0.0062 0.784 0.784
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0718 0.0718
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0062 0.784 1
Schistosoma mansoni DNA polymerase eta 0.0023 0.232 0.232
Brugia malayi nuclear hormone receptor 0.0012 0.0718 0.0718
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0012 0.0718 0.5
Onchocerca volvulus 0.0012 0.0718 0.5
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0023 0.232 0.232
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.232 0.296
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0062 0.784 1
Brugia malayi RNA recognition motif domain containing protein 0.0076 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.232 0.296
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0012 0.0718 0.0718
Mycobacterium tuberculosis Conserved hypothetical protein 0.0023 0.232 0.5
Brugia malayi MAP kinase sur-1 0.0062 0.784 0.784
Loa Loa (eye worm) hypothetical protein 0.0012 0.0718 0.0718
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0062 0.784 1
Schistosoma mansoni RAR-like nuclear receptor 0.0012 0.0718 0.0718
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.232 0.296
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.232 0.296
Brugia malayi ecdysteroid receptor 0.0012 0.0718 0.0718

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 3.9811 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) 7.0795 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 of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 17.7828 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 17.7828 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 23.1093 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 26.8545 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) = 70.7946 um PUBCHEM_BIOASSAY: qHTS Fluorescence Polarization Assay for Inhibitors of MLL CXXC domain - DNA interaction. (Class of assay: confirmatory) [Related pubchem assays: 2698 (Summary assay.)] ChEMBL. No reference
Potency (functional) 89.1251 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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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