Detailed information for compound 925193

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 490.458 | Formula: C21H17F3N6O3S
  • H donors: 2 H acceptors: 6 LogP: 3.13 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C(F)(F)F)c1cnc2c(c1)c(C)nc(n2)N
  • InChi: 1S/C21H17F3N6O3S/c1-11-16-7-12(9-26-18(16)29-20(25)28-11)13-8-17(19(33-2)27-10-13)30-34(31,32)15-5-3-14(4-6-15)21(22,23)24/h3-10,30H,1-2H3,(H2,25,26,28,29)
  • InChiKey: KQEBASQDUJBNAH-UHFFFAOYSA-N  


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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
Loa Loa (eye worm) phosphatidylinositol 3 Get druggable targets OG5_127444 All targets in OG5_127444
Loa Loa (eye worm) 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
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
Trichomonas vaginalis PIKK family atypical protein kinase 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
Entamoeba histolytica phosphatidylinositol 3-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
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
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
Entamoeba histolytica phosphatidylinositol 3-kinase, putative Get druggable targets OG5_127444 All targets in OG5_127444
Trypanosoma brucei gambiense 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 donovani Phosphatidylinositol 3-kinase tor1 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
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 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
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
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_127444 All targets in OG5_127444
Trichomonas vaginalis PIKK family atypical protein kinase 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
Trichomonas vaginalis phosphatidylinositol kinase, putative Get druggable targets OG5_127444 All targets in OG5_127444
Candida albicans frameshifted from upsteam TOR2 CDS (CaP19.9461) Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, 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
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 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
Leishmania braziliensis 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 cruzi phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
Giardia lamblia GTOR 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
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
Echinococcus granulosus FKBP12 rapamycin complex associated 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
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative Get druggable targets OG5_127444 All targets in OG5_127444
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 phopsphatidylinositol 3-kinase, drosophila, putative Get druggable targets OG5_127444 All targets in OG5_127444
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 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
Leishmania donovani phosphatidylinositol 3-kinase 2, 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
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
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
Leishmania infantum target of rapamycin (TOR) kinase 1, 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
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase Get druggable targets OG5_127444 All targets in OG5_127444
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 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
Trichomonas vaginalis PIKK family atypical protein kinase 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
Trypanosoma brucei gambiense phosphatidylinositol 3-kinase tor, putative 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
Trypanosoma congolense Phosphatidylinositol 3-kinase tor2 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
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 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
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 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
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
Leishmania mexicana phosphatidylinositol 3-kinase (tor2)-like protein 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
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative 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
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
Leishmania major target of rapamycin (TOR) kinase 1, 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
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
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0019 0.0129 0.0476
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.04 0.0877
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0174 0.0314
Leishmania major UDP-galactopyranose mutase 0.0045 0.0545 0.3572
Echinococcus multilocularis Regulator of G protein signaling 20 0.0019 0.0126 0.0204
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0019 0.0129 0.0203
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.0045 0.0545 0.0813
Loa Loa (eye worm) hypothetical protein 0.0045 0.0545 0.1336
Brugia malayi regulator of G-protein signaling rgs-7 0.0019 0.0126 0.0305
Toxoplasma gondii aldehyde dehydrogenase 0.0059 0.077 1
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0058 0.0747 0.4074
Loa Loa (eye worm) glutaminase 2 0.0267 0.4066 1
Plasmodium falciparum phd finger protein, putative 0.0028 0.0281 0.5118
Schistosoma mansoni eyes absent homolog 0.0086 0.1195 0.1874
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0059 0.077 0.0254
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0019 0.0126 0.0204
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0028 0.0281 0.0381
Loa Loa (eye worm) hypothetical protein 0.0086 0.1195 0.2935
Entamoeba histolytica hypothetical protein 0.0098 0.138 0.7763
Brugia malayi SWIRM domain containing protein 0.0045 0.0545 0.1336
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0126 0.0195
Plasmodium vivax hypothetical protein, conserved 0.0045 0.0545 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0571 0.1301
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0122 0.1764 0.4272
Loa Loa (eye worm) phosphatidylinositol 3 0.0022 0.0174 0.0423
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0058 0.0747 0.1211
Brugia malayi hypothetical protein 0.0086 0.1195 0.2935
Giardia lamblia GTOR 0.0058 0.0747 0.4607
Schistosoma mansoni z-protein (S1r protein) 0.0019 0.0126 0.0128
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0126 0.0128
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0019 0.0126 0.0204
Loa Loa (eye worm) hypothetical protein 0.0019 0.0126 0.0305
Brugia malayi A-kinase anchor protein 10, precursor 0.0019 0.0126 0.0305
Echinococcus granulosus cpg binding protein 0.003 0.0299 0.0485
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0526 0.1191
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0092 0.1293 1
Echinococcus multilocularis cpg binding protein 0.003 0.0299 0.0485
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0029 0.0292 0.1966
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0019 0.0129 0.1131
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.1679 0.4127
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.0747 0.1741
Echinococcus multilocularis dnaJ subfamily B 0.0399 0.6169 1
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0022 0.0174 0.0735
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0019 0.0129 0.0476
Echinococcus multilocularis Zinc finger, PHD finger 0.0019 0.0129 0.021
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.035 0.0753
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0174 0.0314
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0019 0.0129 0.0476
Schistosoma mansoni cpg binding protein 0.003 0.0299 0.0411
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0022 0.0174 0.0735
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0019 0.0129 0.021
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0395 0.0864
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.0747 0.1741
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0104 0.1485 0.3648
Brugia malayi Regulator of G protein signaling domain containing protein 0.0019 0.0126 0.0305
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0019 0.0129 0.2322
Echinococcus multilocularis 0.0045 0.0545 0.0883
Schistosoma mansoni axis inhibition protein axin 0.0019 0.0126 0.0128
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0019 0.0129 0.0203
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0043 0.0513 0.2713
Loa Loa (eye worm) hypothetical protein 0.0019 0.0126 0.0305
Echinococcus multilocularis axis inhibition protein axin 0.0019 0.0126 0.0204
Trichomonas vaginalis regulator of G protein signaling 5, rgs5, putative 0.0019 0.0126 0.0195
Loa Loa (eye worm) hypothetical protein 0.0045 0.0545 0.1336
Loa Loa (eye worm) hypothetical protein 0.0019 0.0126 0.0305
Mycobacterium tuberculosis Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase 0.0602 0.9403 1
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.0014 0.0048 0.0077
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0059 0.0773 0.1185
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.1293 0.3099
Brugia malayi hypothetical protein 0.0045 0.0545 0.1336
Brugia malayi jmjC domain containing protein 0.0093 0.1309 0.3216
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0022 0.0174 0.0423
Schistosoma mansoni kinase 0.0047 0.0573 0.0858
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0043 0.0513 0.1159
Trichomonas vaginalis CAMK family protein kinase 0.0046 0.0554 0.1259
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0274 0.0669
Trichomonas vaginalis glutaminase, putative 0.0267 0.4066 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0036 0.0402 0.0984
Brugia malayi hypothetical protein 0.0019 0.0126 0.0305
Loa Loa (eye worm) hypothetical protein 0.0028 0.0281 0.0686
Schistosoma mansoni serine/threonine protein kinase 0.0092 0.1293 0.2034
Loa Loa (eye worm) hypothetical protein 0.0019 0.0126 0.0305
Echinococcus multilocularis regulator of G protein signaling 0.0019 0.0126 0.0204
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.008 0.1102 0.2707
Toxoplasma gondii histone lysine methyltransferase SET1 0.0053 0.0672 0.8646
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0036 0.0402 0.2064
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0174 0.0314
Brugia malayi PXA domain containing protein 0.0019 0.0126 0.0305
Schistosoma mansoni jumonji/arid domain-containing protein 0.0036 0.0401 0.0578
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0022 0.0174 0.1013
Schistosoma mansoni amine oxidase 0.0045 0.0545 0.0813
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0043 0.0513 0.0761
Brugia malayi PXA domain containing protein 0.0019 0.0126 0.0305
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0126 0.0128
Echinococcus multilocularis lysine specific demethylase 5A 0.0034 0.0376 0.0609
Schistosoma mansoni jumonji domain containing protein 0.0074 0.1005 0.1563
Mycobacterium leprae PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO) 0.0045 0.0545 0.5
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0122 0.1764 0.4272
Echinococcus granulosus regulator of G protein signaling 7 0.0019 0.0126 0.0204
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0058 0.0747 0.4074
Plasmodium vivax protoporphyrinogen oxidase, putative 0.0045 0.0545 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.077 0.0238
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0571 0.1301
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0019 0.0129 0.021
Loa Loa (eye worm) jmjC domain-containing protein 0.0059 0.0762 0.187
Echinococcus granulosus expressed protein 0.0364 0.5615 0.9101
Mycobacterium ulcerans glutaminase 0.0267 0.4066 0.3724
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0016 0.0087 0.0064
Loa Loa (eye worm) phosphatidylinositol 3 0.0202 0.3036 0.7466
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0019 0.0129 0.021
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0463 0.1034
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0122 0.1764 1
Entamoeba histolytica serine/threonine protein kinase, putative 0.0092 0.1293 0.7254
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.008 0.1102 0.1786
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0045 0.0545 1
Trypanosoma cruzi polo-like protein kinase, putative 0.0092 0.1293 0.7254
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.1293 0.3099
Giardia lamblia Kinase, PLK 0.0092 0.1293 1
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0226 0.342 0.5544
Loa Loa (eye worm) hypothetical protein 0.0045 0.0545 0.1336
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.04 0.0877
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0019 0.0129 0.0476
Echinococcus multilocularis regulator of G protein signaling 3 0.0019 0.0126 0.0204
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0085 0.1176 0.2807
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0019 0.0126 0.0128
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.035 0.0753
Echinococcus granulosus regulator of G protein signaling 3 0.0019 0.0126 0.0204
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0019 0.0126 0.0128
Echinococcus granulosus axis inhibition protein axin 0.0019 0.0126 0.0204
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0045 0.0545 0.0813
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0019 0.0129 0.0656
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0043 0.0513 0.2713
Echinococcus granulosus peregrin 0.0028 0.0281 0.0455
Echinococcus multilocularis peregrin 0.0028 0.0281 0.0455
Onchocerca volvulus Alhambra homolog 0.0028 0.0281 0.0066
Loa Loa (eye worm) hypothetical protein 0.008 0.1102 0.2707
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0061 0.0792 0.5048
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0058 0.0747 0.4074
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0019 0.0131 0.0317
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0014 0.0048 0.0113
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0571 0.1301
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0058 0.0747 0.5309
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0115 0.1653 0.9352
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0019 0.0129 0.0314
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.035 0.0751
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0031 0.0324 0.0428
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0395 0.0864
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0131 0.0136
Echinococcus granulosus jumonji domain containing protein 0.004 0.0458 0.0742
Loa Loa (eye worm) hypothetical protein 0.0086 0.1195 0.2935
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0047 0.0571 0.4205
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0019 0.0129 0.0134
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0092 0.1293 0.3177
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.035 0.0753
Echinococcus granulosus lysine specific demethylase 5A 0.0036 0.0401 0.065
Schistosoma mansoni jumonji/arid domain-containing protein 0.0036 0.0401 0.0578
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0059 0.077 0.1248
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0122 0.1764 1
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.0595 0.9284 0.9865
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0526 0.1191
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0126 0.0195
Schistosoma mansoni axis inhibition protein axin 0.0019 0.0126 0.0128
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0058 0.0747 0.1211
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0126 0.0195
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.1679 0.4127
Echinococcus multilocularis jumonji domain containing protein 0.004 0.0458 0.0742
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.1293 0.3099
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.077 0.118
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0526 0.1191
Trypanosoma cruzi UDP-galactopyranose mutase 0.0045 0.0545 0.2897
Entamoeba histolytica hypothetical protein 0.0019 0.0126 0.0456
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0093 0.1309 0.2122
Onchocerca volvulus 0.0045 0.0545 0.266
Plasmodium vivax hypothetical protein, conserved 0.0028 0.0281 0.5118
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.008 0.1102 0.1786
Leishmania major phosphatidylinositol 3-kinase, putative 0.0022 0.0174 0.0382
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0092 0.1293 0.2096
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0056 0.0718 0.3905
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.077 0.0238
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0059 0.077 0.1248
Brugia malayi PHD-finger family protein 0.0028 0.0281 0.0686
Trichomonas vaginalis CAMK family protein kinase 0.0046 0.0554 0.1259
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0571 0.1301
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0019 0.0131 0.0317
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0116 0.017
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.04 0.0877
Plasmodium vivax lysine-specific histone demethylase 1, putative 0.0045 0.0545 1
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.0047 0.0572 0.7262
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.1293 0.3099
Loa Loa (eye worm) hypothetical protein 0.0045 0.0545 0.1336
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0022 0.0174 0.1013
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0131 0.0136
Loa Loa (eye worm) hypothetical protein 0.0019 0.0126 0.0305
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0043 0.0513 0.1159
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0022 0.0174 0.0206
Loa Loa (eye worm) PXA domain-containing protein 0.0019 0.0126 0.0305
Echinococcus multilocularis expressed protein 0.0364 0.5615 0.9101
Toxoplasma gondii target of rapamycin (TOR), putative 0.0044 0.0526 0.6623
Entamoeba histolytica hypothetical protein 0.0019 0.0126 0.0456
Plasmodium falciparum protoporphyrinogen oxidase 0.0045 0.0545 1
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.077 0.118
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0059 0.077 0.5506
Loa Loa (eye worm) hypothetical protein 0.0011 0.0005 0.0007
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.0281 0.3227
Brugia malayi F/Y-rich N-terminus family protein 0.0018 0.0112 0.0272
Echinococcus multilocularis regulator of G protein signaling 7 0.0019 0.0126 0.0204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.035 0.0753
Echinococcus granulosus beta-adrenergic receptor kinase 0.0019 0.0131 0.0212
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.035 0.0751
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0526 0.1191
Echinococcus granulosus Regulator of G protein signaling 20 0.0019 0.0126 0.0204
Toxoplasma gondii histone lysine-specific demethylase 0.0045 0.0545 0.6886
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0058 0.0747 0.1143
Plasmodium falciparum lysine-specific histone demethylase 1, putative 0.0045 0.0545 1
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0045 0.0545 0.0883
Echinococcus granulosus regulator of G protein signaling 3 0.0019 0.0126 0.0204
Schistosoma mansoni cpg binding protein 0.003 0.0299 0.0411
Brugia malayi hypothetical protein 0.0019 0.0126 0.0305
Trypanosoma cruzi polo-like protein kinase, putative 0.0092 0.1293 0.7254
Echinococcus multilocularis beta adrenergic receptor kinase 0.0019 0.0131 0.0212
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0126 0.0128
Loa Loa (eye worm) jmjC domain-containing protein 0.0036 0.0401 0.0982
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0022 0.0174 0.0282
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0571 0.1301
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0019 0.0129 0.2322
Brugia malayi glutaminase DH11.1 0.0267 0.4066 1
Brugia malayi MH2 domain containing protein 0.0116 0.1679 0.4127
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0131 0.0136
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0022 0.0174 0.0282
Toxoplasma gondii non-specific serine/threonine protein kinase 0.0015 0.0066 0.0258
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0058 0.0747 0.5617
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.0747 0.1741
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0019 0.0129 0.1131
Loa Loa (eye worm) RGS-3 protein 0.0019 0.0126 0.0305
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0047 0.0571 0.3798
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0058 0.0747 0.1834
Echinococcus granulosus lysine specific histone demethylase 1A 0.0045 0.0545 0.0883
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0019 0.0129 0.0314
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0019 0.0126 0.0128
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0019 0.0129 0.0134
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0126 0.0195
Echinococcus granulosus axis inhibition protein axin 0.0019 0.0126 0.0204
Loa Loa (eye worm) hypothetical protein 0.0019 0.0126 0.0305
Brugia malayi amine oxidase, flavin-containing family protein 0.0045 0.0545 0.1336
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0126 0.0128
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0093 0.1309 0.2122
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0126 0.0195
Trichomonas vaginalis PIKK family atypical protein kinase 0.005 0.0621 0.1427
Trypanosoma brucei polo-like protein kinase 0.0092 0.1293 1
Echinococcus granulosus dnaJ subfamily B 0.0399 0.6169 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.035 0.0751
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0526 0.1191
Loa Loa (eye worm) hypothetical protein 0.0045 0.0545 0.1336
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.064 1 1
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0122 0.1764 0.4272
Echinococcus granulosus serine protein kinase ATM 0.0014 0.0048 0.0077
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0014 0.0048 0.0113
Onchocerca volvulus Serine\/threonine kinase homolog 0.0092 0.1293 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0526 0.1191
Trypanosoma cruzi UDP-galactopyranose mutase 0.0045 0.0545 0.2897
Brugia malayi serine/threonine-protein kinase plk-2 0.0092 0.1293 0.3177
Trichomonas vaginalis PIKK family atypical protein kinase 0.0039 0.0444 0.0988
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0058 0.0747 0.5309
Loa Loa (eye worm) phosphatidylinositol 3 0.0058 0.0747 0.1834
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0122 0.1764 0.4337
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0058 0.0747 0.4074
Loa Loa (eye worm) PHD-finger family protein 0.0028 0.0281 0.0686
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0043 0.0513 0.2713
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.077 0.0238
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0174 0.0314
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0043 0.0513 0.1159
Schistosoma mansoni cpg binding protein 0.0028 0.0274 0.037
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0043 0.0513 0.3739
Echinococcus multilocularis axis inhibition protein axin 0.0019 0.0126 0.0204
Schistosoma mansoni hypothetical protein 0.0028 0.0281 0.0381
Loa Loa (eye worm) glutaminase 0.0267 0.4066 1
Echinococcus granulosus lysine specific histone demethylase 1A 0.0045 0.0545 0.0883
Loa Loa (eye worm) hypothetical protein 0.0015 0.0066 0.0158
Mycobacterium ulcerans bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ACP synthetase 0.0602 0.9403 0.9369
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0122 0.1764 1
Echinococcus granulosus PHD finger protein rhinoceros 0.0028 0.0281 0.0455
Plasmodium vivax hypothetical protein, conserved 0.0045 0.0545 1
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0019 0.0126 0.0305
Loa Loa (eye worm) hypothetical protein 0.0014 0.0048 0.0113
Entamoeba histolytica hypothetical protein 0.0019 0.0126 0.0456
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0019 0.0129 0.0203
Echinococcus granulosus regulator of G protein signaling 7 0.0019 0.0126 0.0204
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0058 0.0747 0.5617
Chlamydia trachomatis protoporphyrinogen oxidase 0.0045 0.0545 0.5
Loa Loa (eye worm) hypothetical protein 0.0049 0.0604 0.148
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.1293 0.3099
Trichomonas vaginalis conserved hypothetical protein 0.0015 0.0066 0.0046
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0126 0.0128
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.0281 0.3227
Echinococcus granulosus serine:threonine protein kinase SMG1 0.0014 0.0048 0.0077
Brugia malayi Regulator of G protein signaling domain containing protein 0.0019 0.0126 0.0305
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0026 0.0243 0.1567
Echinococcus multilocularis protoporphyrinogen oxidase 0.0045 0.0545 0.0883
Brugia malayi jmjC domain containing protein 0.0036 0.0401 0.0982
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0043 0.0513 0.1258
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0226 0.342 0.5544
Schistosoma mansoni glutaminase 0.0267 0.4066 0.6565
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0226 0.342 0.5509
Trypanosoma cruzi target of rapamycin kinase 3 0.0047 0.0571 0.305
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.1293 0.3099
Leishmania major phosphatidylinositol 3-related kinase, putative 0.0022 0.0174 0.0382
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0019 0.0131 0.0317
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0092 0.1293 0.2096
Brugia malayi regulator of G-protein signaling egl-10 0.0019 0.0126 0.0305
Echinococcus multilocularis regulator of G protein signaling 3 0.0019 0.0126 0.0204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0526 0.1191
Brugia malayi CXXC zinc finger family protein 0.0028 0.0274 0.0669
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0174 0.0314
Echinococcus multilocularis serine protein kinase ATM 0.0014 0.0048 0.0077
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0098 0.138 0.7763
Echinococcus multilocularis regulator of G protein signaling 7 0.0019 0.0126 0.0204
Schistosoma mansoni hypothetical protein 0.0399 0.6169 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0085 0.1176 0.2807
Loa Loa (eye worm) hypothetical protein 0.0045 0.0545 0.1336
Echinococcus multilocularis PHD finger protein rhinoceros 0.0028 0.0281 0.0455
Schistosoma mansoni amine oxidase 0.0045 0.0545 0.0813
Brugia malayi Bromodomain containing protein 0.0028 0.0281 0.0686
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.1293 0.3099
Loa Loa (eye worm) hypothetical protein 0.0042 0.0491 0.1204
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0126 0.0195

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 8.41 nM Inhibition of PI3Kalpha (unknown origin) using PIP2/PS as substrate preincubated for 15 mins before substrate addition by luciferase-based luminescence assay ChEMBL. 25139570
IC50 (binding) = 67 nM Inhibition of mTOR (unknown origin) assessed as inhibition of 4EBP-1 phosphorylation preincubated for 15 mins before substrate addition by TR-FRET assay ChEMBL. 25139570

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.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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