Detailed information for compound 1187141

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 339.411 | Formula: C18H17N3O2S
  • H donors: 1 H acceptors: 3 LogP: 3.32 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Oc1ccc(cc1)c1nc(N2CC3CCC(C2)O3)c2c(n1)ccs2
  • InChi: 1S/C18H17N3O2S/c22-12-3-1-11(2-4-12)17-19-15-7-8-24-16(15)18(20-17)21-9-13-5-6-14(10-21)23-13/h1-4,7-8,13-14,22H,5-6,9-10H2
  • InChiKey: QVNZNYAMDUBKRR-UHFFFAOYSA-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 phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit alpha Starlite/ChEMBL References
Homo sapiens mechanistic target of rapamycin (serine/threonine kinase) Starlite/ChEMBL 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
Giardia lamblia GTOR Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania mexicana phosphatidylinositol 3-kinase, putative Get druggable targets OG5_127444 All targets in OG5_127444
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
Loa Loa (eye worm) phosphatidylinositol 3 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
Trichomonas vaginalis PIKK family atypical protein kinase 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
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
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide Get druggable targets OG5_127444 All targets in OG5_127444
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein Get druggable targets OG5_127444 All targets in OG5_127444
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 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
Trichomonas vaginalis phosphatidylinositol kinase, putative Get druggable targets OG5_127444 All targets in OG5_127444
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 mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K Get druggable targets OG5_127444 All targets in OG5_127444
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 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
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127444 All targets in OG5_127444
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase Get druggable targets OG5_127444 All targets in OG5_127444
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
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
Leishmania mexicana phosphatidylinositol 3 kinase, putative 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
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
Leishmania donovani Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania infantum phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
Trypanosoma brucei gambiense phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) phosphatidylinositol 3 Get druggable targets OG5_127444 All targets in OG5_127444
Entamoeba histolytica phosphatidylinositol 3-kinase, putative Get druggable targets OG5_127444 All targets in OG5_127444
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
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase Get druggable targets OG5_127444 All targets in OG5_127444
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum ko:K00922 phosphatidylinositol-4,5-bisphosphate 3-kinase [EC2.7.1.153], putative Get druggable targets OG5_127444 All targets in OG5_127444
Leishmania major 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
Trypanosoma congolense 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
Trypanosoma congolense Phosphatidylinositol 3-kinase tor1 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 phosphatidylinositol 3-kinase class, putative Get druggable targets OG5_127444 All targets in OG5_127444
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica phosphatidylinositol 3-kinase, putative Get druggable targets OG5_127444 All targets in OG5_127444
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative 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
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative Get druggable targets OG5_127444 All targets in OG5_127444
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative Get druggable targets OG5_127444 All targets in OG5_127444
Candida albicans frameshifted from upstream TOR2 CDS (CaP19.1905) 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
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
Schistosoma japonicum ko:K07203 FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative Get druggable targets OG5_127444 All targets in OG5_127444
Leishmania major target of rapamycin (TOR) kinase 1, putative Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 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
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
Trichomonas vaginalis PIKK family atypical protein kinase 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
Leishmania donovani phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
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
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
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 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
Brugia malayi Phosphatidylinositol 3- and 4-kinase family 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
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127444 All targets in OG5_127444
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 brucei gambiense phosphatidylinositol 3 kinase, putative 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 phosphatidylinositol 3-kinase 1, putative Get druggable targets OG5_127444 All targets in OG5_127444
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Entamoeba histolytica phosphatidylinositol 3-kinase, putative phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit alpha 1068 aa 927 aa 29.0 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0047 0.1064 0.7048
Loa Loa (eye worm) MH2 domain-containing protein 0.0139 0.4796 0.6557
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.008 0.241 0.2859
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.095 0.2215
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0226 0.8289 1
Onchocerca volvulus 0.0042 0.0875 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.1063 0.2495
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0043 0.0917 0.2135
Trichomonas vaginalis PIKK family atypical protein kinase 0.005 0.119 0.2812
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0022 0.0056 0.0138
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0115 0.3808 0.911
Brugia malayi beta-lactamase family protein 0.0042 0.0875 0.1824
Leishmania major phosphatidylinositol 3-kinase, putative 0.0022 0.0056 0.0373
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0098 0.3116 0.6931
Leishmania major hypothetical protein, conserved 0.0042 0.0875 0.5793
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0042 0.0875 0.1196
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0067 0.1863 0.2981
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.008 0.241 0.2859
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.1063 0.2495
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0036 0.0635 0.1553
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0056 0.1437 0.1637
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.063 0.1422
Onchocerca volvulus 0.0042 0.0875 0.5
Loa Loa (eye worm) hypothetical protein 0.008 0.241 0.3295
Trypanosoma brucei hypothetical protein, conserved 0.0042 0.0875 0.5793
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0022 0.0056 0.0373
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0122 0.409 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.095 0.2215
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.151 0.3605
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0043 0.0917 0.1046
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0122 0.409 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.0875 0.1196
Loa Loa (eye worm) hypothetical protein 0.0042 0.0875 0.1196
Mycobacterium ulcerans hypothetical protein 0.0042 0.0875 0.5
Mycobacterium leprae conserved hypothetical protein 0.0042 0.0875 0.5
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0043 0.0917 0.1913
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0058 0.151 0.3693
Toxoplasma gondii ABC1 family protein 0.0042 0.0875 0.9212
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0043 0.0917 0.2135
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0058 0.151 0.3693
Loa Loa (eye worm) phosphatidylinositol 3 0.0202 0.7315 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0058 0.151 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0122 0.409 1
Mycobacterium ulcerans esterase/lipase LipP 0.0042 0.0875 0.5
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0122 0.409 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.0875 0.0994
Loa Loa (eye worm) phosphatidylinositol 3 0.0058 0.151 0.2065
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0502 0.1105
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.1063 0.2495
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.063 0.1422
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0875 0.2139
Leishmania major phosphatidylinositol 3-related kinase, putative 0.0022 0.0056 0.0373
Brugia malayi beta-lactamase 0.0042 0.0875 0.1824
Onchocerca volvulus 0.0042 0.0875 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.004 0.08 0.1668
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.095 0.2215
Loa Loa (eye worm) hypothetical protein 0.0042 0.0861 0.1177
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0058 0.151 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0022 0.0056 0.0077
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0502 0.1105
Loa Loa (eye worm) hypothetical protein 0.0042 0.0875 0.1196
Plasmodium vivax hypothetical protein, conserved 0.0042 0.0875 1
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0058 0.151 0.1869
Mycobacterium ulcerans beta-lactamase 0.0042 0.0875 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0875 0.2139
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.1063 0.2495
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.095 0.2215
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.008 0.241 0.5025
Loa Loa (eye worm) hypothetical protein 0.0067 0.1863 0.2547
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0875 0.2029
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.0875 0.2029
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0122 0.409 1
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0061 0.1623 1
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0122 0.409 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0022 0.0056 0.0117
Loa Loa (eye worm) transcription factor SMAD2 0.0139 0.4796 0.6557
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0042 0.0875 0.5
Loa Loa (eye worm) hypothetical protein 0.0042 0.0875 0.1196
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0047 0.1064 0.7048
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.1063 0.2495
Echinococcus granulosus beta LACTamase domain containing family member 0.0042 0.0875 0.0994
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.079 0.1819
Mycobacterium leprae Probable lipase LipE 0.0042 0.0875 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.151 0.3605
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0504 0.111
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0058 0.151 0.1766
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0122 0.409 0.8527
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0058 0.151 0.1766
Giardia lamblia GTOR 0.0058 0.151 0.9047
Entamoeba histolytica hypothetical protein 0.0098 0.3116 0.6931
Brugia malayi MH2 domain containing protein 0.0139 0.4796 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.0875 0.2029
Loa Loa (eye worm) beta-lactamase 0.0042 0.0875 0.1196
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.095 0.2215
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0504 0.111
Echinococcus multilocularis beta LACTamase domain containing family member 0.0042 0.0875 0.0994
Loa Loa (eye worm) hypothetical protein 0.0042 0.0875 0.1196
Toxoplasma gondii target of rapamycin (TOR), putative 0.0044 0.095 1
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0058 0.151 0.1766
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0504 0.111
Loa Loa (eye worm) phosphatidylinositol 3 0.0036 0.0635 0.0868
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0502 0.1105
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0058 0.151 1
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0104 0.3381 0.7048
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.095 0.2215
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0042 0.0875 0.1824
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.0875 0.0994
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0043 0.0917 0.2135
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0226 0.8289 1
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0029 0.0357 0.2365
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0043 0.0917 0.2243
Mycobacterium ulcerans lipase LipD 0.0042 0.0875 0.5
Trichomonas vaginalis esterase, putative 0.0042 0.0875 0.2029
Brugia malayi beta-lactamase family protein 0.0042 0.0875 0.1824
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0067 0.1863 0.2981
Loa Loa (eye worm) hypothetical protein 0.004 0.08 0.1094
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0058 0.151 0.1869
Loa Loa (eye worm) pigment dispersing factor receptor c 0.004 0.08 0.1094
Trichomonas vaginalis PIKK family atypical protein kinase 0.0039 0.0743 0.1702
Schistosoma mansoni hypothetical protein 0.0027 0.0288 0.0282
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0022 0.0056 0.0373
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0026 0.0231 0.1531
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0043 0.0917 0.6074
Loa Loa (eye worm) hypothetical protein 0.0042 0.0875 0.1196
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.095 0.2215
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0875 0.2029
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0617 0.139
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0058 0.151 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0058 0.151 0.3149
Brugia malayi latrophilin 2 splice variant baaae 0.0027 0.0288 0.0601
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0085 0.2597 0.6299
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0875 0.2029
Trypanosoma cruzi target of rapamycin kinase 3 0.0047 0.1064 0.2603
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.063 0.1422
Loa Loa (eye worm) hypothetical protein 0.0027 0.0288 0.0394
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0022 0.0056 0.0138
Brugia malayi Calcitonin receptor-like protein seb-1 0.004 0.08 0.1668
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0617 0.139
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0504 0.111
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0226 0.8289 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0085 0.2597 0.6299
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.151 0.3605

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 32 nM Inhibition of mTOR ChEMBL. 19897362
IC50 (functional) = 2800 nM Cytotoxicity against human LNCAP cells ChEMBL. 19897362
IC50 (binding) = 6270 nM Inhibition of PI3Kalpha ChEMBL. 19897362

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 19897362

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

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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