Detailed information for compound 1361233

Basic information

Technical information
  • TDR Targets ID: 1361233
  • Name: ethyl 2-(3-cyano-6-phenylpyridin-2-yl)sulfany lpropanoate
  • MW: 312.386 | Formula: C17H16N2O2S
  • H donors: 0 H acceptors: 3 LogP: 3.77 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)C(Sc1nc(ccc1C#N)c1ccccc1)C
  • InChi: 1S/C17H16N2O2S/c1-3-21-17(20)12(2)22-16-14(11-18)9-10-15(19-16)13-7-5-4-6-8-13/h4-10,12H,3H2,1-2H3
  • InChiKey: LBOVBOOXCIMCNH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • ethyl 2-[(3-cyano-6-phenyl-2-pyridyl)sulfanyl]propanoate
  • 2-[(3-cyano-6-phenyl-2-pyridyl)thio]propanoic acid ethyl ester
  • 2-[(3-cyano-6-phenyl-2-pyridyl)thio]propionic acid ethyl ester
  • ethyl 2-(3-cyano-6-phenyl-pyridin-2-yl)sulfanylpropanoate
  • NCGC00103220-01
  • 2-(3-Cyano-6-phenyl-pyridin-2-ylsulfanyl)-propionic acid ethyl ester
  • BAS 07415995

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Homo sapiens mechanistic target of rapamycin (serine/threonine kinase) Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania braziliensis target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) phosphatidylinositol 3 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania mexicana phosphatidylinositol 3 kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania infantum target of rapamycin (TOR) kinase 1, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania infantum target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Giardia lamblia GTOR Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans frameshifted from upsteam TOR2 CDS (CaP19.9461) Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127212 All targets in OG5_127212
Toxoplasma gondii target of rapamycin (TOR), putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans frameshifted from upstream TOR2 CDS (CaP19.1905) Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania mexicana phosphatidylinositol 3-kinase (tor2)-like protein Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania major target of rapamycin (TOR) kinase 1, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei gambiense phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma congolense Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Echinococcus multilocularis FKBP12 rapamycin complex associated protein Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus granulosus FKBP12 rapamycin complex associated protein Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania donovani Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Trypanosoma brucei gambiense phosphatidylinositol 3 kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania major target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei phosphatidylinositol 4-kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma congolense Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative Get druggable targets OG5_127212 All targets in OG5_127212
Neospora caninum Phosphatidylinositol 3-kinase tor2, related Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum ko:K07203 FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania donovani Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
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 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.0306 0.6922
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0054 0.0442 0.3747
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0054 0.0442 0.0442
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0114 0.1181 1
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0042 0.029 1
Echinococcus multilocularis protein quaking 0.0028 0.0118 0.0118
Echinococcus granulosus histone acetyltransferase KAT2B 0.0042 0.029 0.029
Echinococcus multilocularis GPCR, family 2 0.0019 0.001 0.001
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0136 0.3078
Loa Loa (eye worm) cytochrome P450 family protein 0.0023 0.0053 0.0139
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0136 0.3078
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0042 0.029 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0515 0.1352
Echinococcus granulosus protein quaking 0.0028 0.0118 0.0118
Echinococcus granulosus hypothetical protein 0.0028 0.0118 0.0118
Brugia malayi Latrophilin receptor protein 2 0.0019 0.001 0.0027
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0136 0.3066
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.001 0.0027
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0223 0.5047
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0142 0.1523 0.1523
Loa Loa (eye worm) hypothetical protein 0.006 0.0515 0.1352
Brugia malayi Temporarily assigned gene name protein 44 0.0028 0.0118 0.031
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0114 0.1181 1
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0003 0.0075
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0042 0.029 0.6561
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0054 0.0442 0.0442
Brugia malayi tumor suppressor. 0.0329 0.3812 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0051 0.0407 0.1068
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0054 0.0442 1
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0026 0.0092 0.0775
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0054 0.0442 0.3747
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0003 0.0003
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0114 0.1181 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.0306 0.6922
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0043 0.0307 0.2598
Trypanosoma cruzi cytochrome P450, putative 0.0023 0.0053 0.0448
Trypanosoma brucei variant surface glycoprotein (VSG), putative 0.0114 0.1181 1
Schistosoma mansoni hypothetical protein 0.0019 0.001 0.001
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0023 0.0053 0.0451
Trichomonas vaginalis bromodomain-containing protein, putative 0.0042 0.029 0.6561
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.0209 0.4722
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0003 0.5
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0023 0.0053 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.001 0.001
Loa Loa (eye worm) hypothetical protein 0.0019 0.001 0.0027
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0003 0.0028
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0171 0.3855
Echinococcus multilocularis microtubule associated protein 2 0.0833 1 1
Trypanosoma brucei hypothetical protein 0.0114 0.1181 1
Echinococcus granulosus GPCR family 2 0.0019 0.001 0.001
Brugia malayi Cytochrome P450 family protein 0.0051 0.0407 0.1068
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.001 0.001
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0054 0.0442 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0272 0.6145
Schistosoma mansoni hypothetical protein 0.0028 0.0118 0.0118
Toxoplasma gondii target of rapamycin (TOR), putative 0.004 0.0272 0.9358
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0272 0.6145
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0272 0.6145
Giardia lamblia Histone acetyltransferase GCN5 0.0038 0.0248 0.556
Giardia lamblia GTOR 0.0054 0.0442 1
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0114 0.1181 1
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0043 0.0307 0.2598
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.001 0.0027
Trypanosoma brucei calpain, putative 0.0114 0.1181 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0175 0.3945
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.0306 0.6922
Schistosoma mansoni hypothetical protein 0.0019 0.001 0.001
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.001 0.001
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0136 0.3078
Brugia malayi acetyltransferase, GNAT family protein 0.0142 0.1523 0.3995
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0171 0.3855
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0175 0.3945
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0054 0.0442 0.3747
Entamoeba histolytica acetyltransferase, GNAT family 0.0038 0.0248 0.556
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0515 0.1352
Loa Loa (eye worm) phosphatidylinositol 3 0.0054 0.0442 0.1161
Schistosoma mansoni hypothetical protein 0.0028 0.0118 0.0118
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0114 0.1181 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.0138 0.1474 0.1474
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0175 0.3945
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.0306 0.6922
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0136 0.3066
Trichomonas vaginalis PIKK family atypical protein kinase 0.0046 0.0345 0.78
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0.0003 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0136 0.3066
Trypanosoma brucei cytochrome P450, putative 0.0023 0.0053 0.0448
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0114 0.1181 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.0442 1
Schistosoma mansoni hypothetical protein 0.0019 0.001 0.001
Schistosoma mansoni hypothetical protein 0.0041 0.0282 0.0282
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.0442 1
Brugia malayi Cytochrome P450 family protein 0.0023 0.0053 0.0139
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0114 0.1181 1
Plasmodium falciparum histone acetyltransferase GCN5 0.0038 0.0248 1
Brugia malayi hypothetical protein 0.0028 0.0118 0.031
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0282 0.0739
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0042 0.029 1
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0114 0.1181 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0003 0.0028
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0003 0.0075
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0272 0.6145
Trypanosoma brucei calpain-like protein, putative 0.0114 0.1181 1
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0054 0.0442 0.3747
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0272 0.6145
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0272 0.6145
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0114 0.1181 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C2, putative 0.0114 0.1181 1
Trypanosoma cruzi cytochrome P450, putative 0.0023 0.0053 0.0448
Loa Loa (eye worm) cytochrome P450 family protein 0.0023 0.0053 0.0139
Loa Loa (eye worm) hypothetical protein 0.0041 0.0282 0.0739
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0003 0.0009
Loa Loa (eye worm) CYP4Cod1 0.0023 0.0053 0.0139
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0114 0.1181 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.0306 0.6922
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0003 0.0003
Loa Loa (eye worm) hypothetical protein 0.0028 0.0118 0.031
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0114 0.1181 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.0442 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0003 0.0028
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0515 0.1352
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0136 0.3078
Loa Loa (eye worm) acetyltransferase 0.0142 0.1523 0.3995
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0054 0.0442 0.3747
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0142 0.1523 0.1523
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0054 0.0442 0.0442
Loa Loa (eye worm) tumor suppressor 0.0329 0.3812 1
Schistosoma mansoni microtubule-associated protein tau 0.0833 1 1
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0054 0.0442 0.3747
Trypanosoma cruzi calpain cysteine peptidase, putative 0.0114 0.1181 1
Schistosoma mansoni hypothetical protein 0.0019 0.001 0.001
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0003 0.0028
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0003 0.0009
Schistosoma mansoni ap endonuclease 0.0018 0.0003 0.0003
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0272 0.6145
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.001 0.001
Schistosoma mansoni ap endonuclease 0.0018 0.0003 0.0003
Trypanosoma cruzi target of rapamycin kinase 3 0.0043 0.0307 0.2598
Brugia malayi Cytochrome P450 family protein 0.0023 0.0053 0.0139
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0054 0.0442 0.1161
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0114 0.1181 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0.0003 0.5
Leishmania major cytochrome p450-like protein 0.0023 0.0053 0.0448

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.0083 uM PUBCHEM_BIOASSAY: IN Cell qHTS Assay for Inhibitors of the mTORC1 Signaling Pathway in MEF (Tsc2-/-, p53-/-) Cells: Sytravon. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2660, AID2666, AID2667, AID2668, AID2681, AID493208] ChEMBL. No reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS of GLP-1 Receptor Agonists. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 12.5893 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 14.6892 uM PUBCHEM_BIOASSAY: Acumen qHTS Assay for Inhibitors of the mTORC1 Signaling Pathway in MEF (Tsc2-/-, p53-/-) Cells: Sytravon. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2660, AID2666, AID2667, AID2668, AID2681, AID504465] ChEMBL. No reference
Potency (functional) = 17.7828 um PUBCHEM_BIOASSAY: Counterscreen qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. This assay monitors tau fibrillation by fluorescence polarization (FP) of Alexa 594-labeled K18 P301L, which does not fibrillize readily but incorporates into growing filaments of unlabeled tau. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 22.3872 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 31.6228 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 31.6228 uM PubChem BioAssay. qHTS Assay for Activators of ClpP. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (binding) = 50.1187 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Tyrosyl-DNA Phosphodiesterase (TDP1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] 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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