Detailed information for compound 508887

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 410.445 | Formula: C21H23FN6O2
  • H donors: 1 H acceptors: 4 LogP: 2.43 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1onc(n1)c1cccnc1)NCCCN1CCN(CC1)c1ccccc1F
  • InChi: 1S/C21H23FN6O2/c22-17-6-1-2-7-18(17)28-13-11-27(12-14-28)10-4-9-24-20(29)21-25-19(26-30-21)16-5-3-8-23-15-16/h1-3,5-8,15H,4,9-14H2,(H,24,29)
  • InChiKey: JTVJCAXXCZOXGL-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 glycogen synthase kinase 3 beta Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Entamoeba histolytica protein kinase, putative Get druggable targets OG5_126888 All targets in OG5_126888
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) Get druggable targets OG5_126888 All targets in OG5_126888
Echinococcus granulosus glycogen synthase kinase 3 beta Get druggable targets OG5_126888 All targets in OG5_126888
Echinococcus multilocularis glycogen synthase kinase 3 beta Get druggable targets OG5_126888 All targets in OG5_126888
Trypanosoma brucei protein kinase, putative Get druggable targets OG5_126888 All targets in OG5_126888
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126888 All targets in OG5_126888
Echinococcus granulosus protein kinase shaggy Get druggable targets OG5_126888 All targets in OG5_126888
Trypanosoma brucei gambiense protein kinase, putative,glycogen synthase kinase, putative Get druggable targets OG5_126888 All targets in OG5_126888
Leishmania infantum glycogen synthase kinase 3 Get druggable targets OG5_126888 All targets in OG5_126888
Giardia lamblia Kinase, CMGC GSK Get druggable targets OG5_126888 All targets in OG5_126888
Candida albicans second truncated form of RIM11 Serine/threonine protein kinase Get druggable targets OG5_126888 All targets in OG5_126888
Leishmania braziliensis protein kinase, putative,glycogen synthase kinase, putative Get druggable targets OG5_126888 All targets in OG5_126888
Candida albicans Serine/threonine protein kinase required for induction of IME2 by Ime1p Get druggable targets OG5_126888 All targets in OG5_126888
Cryptosporidium parvum hypothetical protein Get druggable targets OG5_126888 All targets in OG5_126888
Babesia bovis protein kinase domain containing protein Get druggable targets OG5_126888 All targets in OG5_126888
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126888 All targets in OG5_126888
Schistosoma japonicum ko:K08822 glycogen synthase kinase 3 alpha, putative Get druggable targets OG5_126888 All targets in OG5_126888
Candida albicans hypothetical protein Get druggable targets OG5_126888 All targets in OG5_126888
Loa Loa (eye worm) CMGC/GSK protein kinase Get druggable targets OG5_126888 All targets in OG5_126888
Plasmodium vivax glycogen synthase kinase 3, putative Get druggable targets OG5_126888 All targets in OG5_126888
Plasmodium berghei glycogen synthase kinase 3, putative Get druggable targets OG5_126888 All targets in OG5_126888
Brugia malayi intracellular kinase Get druggable targets OG5_126888 All targets in OG5_126888
Cryptosporidium hominis hypothetical protein Get druggable targets OG5_126888 All targets in OG5_126888
Trypanosoma congolense protein kinase, putative Get druggable targets OG5_126888 All targets in OG5_126888
Leishmania mexicana protein kinase, putative,glycogen synthase kinase, putative Get druggable targets OG5_126888 All targets in OG5_126888
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative Get druggable targets OG5_126888 All targets in OG5_126888
Onchocerca volvulus Get druggable targets OG5_126888 All targets in OG5_126888
Entamoeba histolytica protein kinase domain containing protein Get druggable targets OG5_126888 All targets in OG5_126888
Plasmodium yoelii Protein kinase domain, putative Get druggable targets OG5_126888 All targets in OG5_126888
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 Get druggable targets OG5_126888 All targets in OG5_126888
Trypanosoma cruzi glycogen synthase kinase 3, putative Get druggable targets OG5_126888 All targets in OG5_126888
Leishmania donovani glycogen synthase kinase 3, putative Get druggable targets OG5_126888 All targets in OG5_126888
Candida albicans second truncated form of RIM11 Serine/threonine protein kinase Get druggable targets OG5_126888 All targets in OG5_126888
Plasmodium falciparum glycogen synthase kinase 3 Get druggable targets OG5_126888 All targets in OG5_126888
Echinococcus multilocularis protein kinase shaggy Get druggable targets OG5_126888 All targets in OG5_126888
Entamoeba histolytica protein kinase domain containing protein Get druggable targets OG5_126888 All targets in OG5_126888
Loa Loa (eye worm) CMGC/GSK protein kinase Get druggable targets OG5_126888 All targets in OG5_126888
Giardia lamblia Kinase, CMGC GSK Get druggable targets OG5_126888 All targets in OG5_126888
Neospora caninum hypothetical protein Get druggable targets OG5_126888 All targets in OG5_126888
Plasmodium knowlesi glycogen synthase kinase 3, putative Get druggable targets OG5_126888 All targets in OG5_126888
Theileria parva glycogen synthase kinase, putative Get druggable targets OG5_126888 All targets in OG5_126888
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0264 0.3006 1
Mycobacterium leprae probable uridine phosphorylase 0.0026 0 0.5
Trypanosoma brucei rac serine-threonine kinase, putative 0.0035 0.012 0.0342
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0059 0.0419 0.1189
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0144 0.1494 0.4245
Brugia malayi Hr1 repeat family protein 0.0035 0.012 0.04
Loa Loa (eye worm) MH2 domain-containing protein 0.0127 0.1268 0.422
Onchocerca volvulus 0.003 0.0054 0.0201
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0059 0.0419 0.0419
Schistosoma mansoni patched 1 0.0109 0.1046 0.2581
Entamoeba histolytica protein kinase domain containing protein 0.0059 0.0419 0.2766
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0224 0.2501 0.2501
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.003 0.0046 0.0046
Brugia malayi serine/threonine-protein kinase plk-2 0.0097 0.0893 0.2971
Brugia malayi Pre-SET motif family protein 0.021 0.2324 0.7732
Toxoplasma gondii hypothetical protein 0.0049 0.0294 0.1945
Entamoeba histolytica protein kinase, putative 0.0059 0.0419 0.2766
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0035 0.012 0.04
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.1046 0.3887
Trypanosoma cruzi polo-like protein kinase, putative 0.0097 0.0893 0.2538
Schistosoma mansoni serine/threonine protein kinase 0.0097 0.0893 0.2204
Trichomonas vaginalis CAMK family protein kinase 0.0049 0.0286 0.1062
Treponema pallidum purine nucleoside phosphorylase (deoD) 0.0146 0.1513 1
Toxoplasma gondii Purine nucleoside phosphorylase 0.0146 0.1513 1
Loa Loa (eye worm) AGC/NDR protein kinase 0.0035 0.012 0.04
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0026 0.0002 0.0007
Trichomonas vaginalis AGC family protein kinase 0.0035 0.012 0.0447
Echinococcus multilocularis sterol regulatory element binding protein 0.0109 0.1046 0.1046
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0146 0.1513 0.5624
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0144 0.1494 0.4245
Brugia malayi p70 ribosomal S6 kinase beta 0.0035 0.012 0.04
Echinococcus multilocularis Niemann Pick C1 protein 0.0109 0.1046 0.1046
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0124 0.1237 0.4598
Onchocerca volvulus 0.0059 0.0419 0.1556
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0035 0.012 0.04
Schistosoma mansoni serine/threonine protein kinase 0.0035 0.012 0.0297
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0159 0.1683 0.1683
Schistosoma mansoni hydroxymethylglutaryl-CoA reductase (NADPH) 0.0264 0.3006 0.7419
Echinococcus multilocularis serine:threonine protein kinase N2 0.0035 0.012 0.012
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0054 0.0133
Giardia lamblia Kinase, PLK 0.0097 0.0893 0.722
Entamoeba histolytica protein kinase, putative 0.0035 0.012 0.0795
Loa Loa (eye worm) hypothetical protein 0.0184 0.1991 0.6622
Schistosoma mansoni serine/threonine protein kinase 0.0224 0.2501 0.6173
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0215 0.061
Echinococcus granulosus RNA directed DNA polymerase 0.0159 0.1683 0.4153
Entamoeba histolytica serine/threonine protein kinase, putative 0.0097 0.0893 0.5904
Schistosoma mansoni protein kinase C 0.003 0.0046 0.0113
Loa Loa (eye worm) hypothetical protein 0.003 0.0054 0.018
Brugia malayi Pre-SET motif family protein 0.003 0.0054 0.018
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0305 0.352 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.012 0.04
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0054 0.0133
Trichomonas vaginalis AGC family protein kinase 0.0035 0.012 0.0447
Echinococcus multilocularis geminin 0.0347 0.4052 0.4052
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.0893 0.332
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0097 0.0893 0.2204
Trichomonas vaginalis AGC family protein kinase 0.0035 0.012 0.0447
Echinococcus granulosus Niemann Pick C1 protein 0.0109 0.1046 0.2581
Giardia lamblia Kinase, CMGC GSK 0.0059 0.0419 0.3383
Schistosoma mansoni serine/threonine protein kinase 0.0224 0.2501 0.6173
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0144 0.1494 0.4245
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0035 0.012 0.04
Treponema pallidum uridine phosphorylase (udp) 0.0146 0.1513 1
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0305 0.352 1
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.0893 0.332
Echinococcus multilocularis serine threonine protein kinase 0.02 0.2193 0.2193
Loa Loa (eye worm) hypothetical protein 0.0109 0.1046 0.3479
Trichomonas vaginalis CAMK family protein kinase 0.0049 0.0286 0.1062
Entamoeba histolytica protein kinase, putative 0.0035 0.012 0.0795
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.021 0.2324 0.7732
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase 0.0264 0.3006 0.854
Entamoeba histolytica protein kinase domain containing protein 0.0059 0.0419 0.2766
Mycobacterium tuberculosis Conserved hypothetical protein 0.0161 0.17 0.2564
Trichomonas vaginalis AGC family protein kinase 0.0035 0.012 0.0447
Brugia malayi Protein kinase domain containing protein 0.0035 0.012 0.04
Schistosoma mansoni unc-13 (munc13) 0.003 0.0046 0.0113
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0097 0.0893 0.2538
Loa Loa (eye worm) AGC/PKN protein kinase 0.0035 0.012 0.04
Trichomonas vaginalis AGC family protein kinase 0.0035 0.012 0.0447
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0054 0.0054
Brugia malayi MH2 domain containing protein 0.0127 0.1268 0.422
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0097 0.0893 0.2971
Trypanosoma brucei 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0264 0.3006 0.854
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0059 0.0419 0.1392
Brugia malayi C1-like domain containing protein 0.0026 0.0002 0.0007
Echinococcus multilocularis protein kinase c epsilon type 0.0065 0.0492 0.0492
Echinococcus granulosus C2 calcium dependent membrane targeting 0.003 0.0046 0.0113
Schistosoma mansoni kinase 0.005 0.0302 0.0744
Echinococcus granulosus serine:threonine protein kinase N2 0.0035 0.012 0.0297
Loa Loa (eye worm) hypothetical protein 0.0159 0.1683 0.5598
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0146 0.1513 0.5624
Toxoplasma gondii AGC kinase 0.0035 0.012 0.0795
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0059 0.0419 0.1033
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0065 0.0492 0.1637
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.0035 0.012 0.04
Brugia malayi intracellular kinase 0.0059 0.0419 0.1392
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0146 0.1513 1
Entamoeba histolytica protein kinase, putative 0.0035 0.012 0.0795
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.0893 0.332
Echinococcus multilocularis serine:threonine protein kinase MRCK beta 0.0026 0.0002 0.0002
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.0035 0.012 0.012
Schistosoma mansoni hypothetical protein 0.0347 0.4052 1
Brugia malayi protein kinase C3,putative 0.0026 0.0002 0.0007
Brugia malayi Protein kinase c protein 2 0.0191 0.2075 0.6903
Echinococcus multilocularis protein kinase c iota type 0.006 0.0428 0.0428
Entamoeba histolytica protein kinase, putative 0.0035 0.012 0.0795
Onchocerca volvulus 0.003 0.0046 0.017
Mycobacterium ulcerans hypothetical protein 0.0161 0.17 0.2564
Echinococcus multilocularis protein patched 0.0109 0.1046 0.1046
Brugia malayi Protein kinase domain containing protein 0.0035 0.012 0.04
Trypanosoma cruzi polo-like protein kinase, putative 0.0097 0.0893 0.2538
Trichomonas vaginalis AGC family protein kinase 0.0035 0.012 0.0447
Trichomonas vaginalis AGC family protein kinase 0.0035 0.012 0.0447
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0054 0.0133
Plasmodium falciparum purine nucleoside phosphorylase 0.0146 0.1513 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0052 0.0333 0.0946
Plasmodium vivax glycogen synthase kinase 3, putative 0.0059 0.0419 0.2498
Brugia malayi Hydroxymethylglutaryl-coenzyme A reductase family protein 0.0264 0.3006 1
Trypanosoma brucei polo-like protein kinase 0.0097 0.0893 0.2538
Loa Loa (eye worm) transcription factor SMAD2 0.0127 0.1268 0.422
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0059 0.0419 0.2766
Trichomonas vaginalis AGC family protein kinase 0.0035 0.012 0.0447
Echinococcus granulosus Serine/threonine-protein kinase Genghis Khan 0.0026 0.0002 0.0005
Schistosoma mansoni hypothetical protein 0.0347 0.4052 1
Trichomonas vaginalis serine/threonine-protein kinase sgk, putative 0.0034 0.01 0.0372
Mycobacterium leprae Probable purine nucleoside phosphorylase DeoD (INOSINE PHOSPHORYLASE) (PNP) 0.0026 0 0.5
Schistosoma mansoni unc-13 (munc13) 0.003 0.0046 0.0113
Echinococcus multilocularis protein dispatched 1 0.0109 0.1046 0.1046
Echinococcus granulosus hydroxymethylglutaryl coenzyme A reductase 0.0264 0.3006 0.7419
Leishmania major mitochondrial DNA polymerase beta 0.0305 0.352 1
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0109 0.1046 0.3479
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0146 0.1513 1
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0043 0.0215 0.061
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0054 0.0133
Trichomonas vaginalis AGC family protein kinase 0.0035 0.012 0.0447
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.0166 0.1767 0.5878
Brugia malayi protein kinase C II. 0.0065 0.0492 0.1637
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0109 0.1046 0.2581
Echinococcus granulosus protein kinase shaggy 0.0059 0.0419 0.1033
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.0893 0.332
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0059 0.0419 0.1033
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0097 0.0893 0.0893
Giardia lamblia Kinase, CMGC GSK 0.0059 0.0419 0.3383
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0054 0.0054
Echinococcus granulosus Protein patched homolog 1 0.0109 0.1046 0.2581
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.0893 0.332
Leishmania major 3-hydroxy-3-methylglutaryl-CoA reductase 0.0264 0.3006 0.854
Trichomonas vaginalis AGC family protein kinase 0.0035 0.012 0.0447
Echinococcus granulosus unc 13 munc13 0.003 0.0046 0.0113
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.0035 0.012 0.012
Loa Loa (eye worm) AGC/AKT protein kinase 0.0035 0.012 0.04
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.0035 0.012 0.0297
Echinococcus granulosus protein kinase c iota type 0.006 0.0428 0.1057
Echinococcus multilocularis unc 13 (munc13) 0.003 0.0046 0.0046
Echinococcus multilocularis serine:threonine protein kinase 38 0.0035 0.012 0.012
Trichomonas vaginalis CMGC family protein kinase 0.0059 0.0419 0.1556
Trichomonas vaginalis set domain proteins, putative 0.0239 0.269 1
Schistosoma mansoni protein kinase C mu 0.0026 0.0002 0.0005
Schistosoma mansoni serine/threonine protein kinase 0.0035 0.012 0.0297
Onchocerca volvulus 0.0239 0.269 1
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.0035 0.012 0.0297
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.0035 0.012 0.012
Onchocerca volvulus Serine\/threonine kinase homolog 0.0097 0.0893 0.332
Mycobacterium ulcerans short chain dehydrogenase 0.0552 0.6628 1
Echinococcus granulosus sterol regulatory element binding protein 0.0109 0.1046 0.2581
Trichomonas vaginalis CMGC family protein kinase 0.0059 0.0419 0.1556
Loa Loa (eye worm) hypothetical protein 0.003 0.0046 0.0152
Echinococcus granulosus protein kinase c epsilon type 0.0065 0.0492 0.1215
Echinococcus granulosus protein kinase C gamma type 0.02 0.2193 0.5413
Echinococcus granulosus Protein kinase C brain isozyme 0.0224 0.2501 0.6173
Schistosoma mansoni serine/threonine protein kinase 0.0026 0.0002 0.0005
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0264 0.3006 0.854
Echinococcus multilocularis protein kinase shaggy 0.0059 0.0419 0.0419
Schistosoma mansoni serine/threonine protein kinase 0.0026 0.0002 0.0005
Schistosoma mansoni serine/threonine protein kinase 0.0035 0.012 0.0297
Plasmodium vivax purine nucleoside phosphorylase, putative 0.0146 0.1513 1
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0054 0.0357
Loa Loa (eye worm) AGC/PKC/IOTA protein kinase 0.0026 0.0002 0.0007
Brugia malayi Phorbol esters/diacylglycerol binding domain 0.0026 0.0002 0.0007
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0124 0.1237 0.4598
Echinococcus granulosus NDR protein kinase 0.0035 0.012 0.0297
Echinococcus multilocularis serine:threonine protein kinase N2 0.0035 0.012 0.012
Echinococcus multilocularis hydroxymethylglutaryl coenzyme A reductase 0.0264 0.3006 0.3006
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0059 0.0419 0.1392
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0124 0.1237 0.4598
Brugia malayi Protein kinase domain containing protein 0.0035 0.012 0.04
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0029 0.004 0.0099
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0043 0.0215 0.061
Brugia malayi Protein kinase domain containing protein 0.0026 0.0002 0.0007
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.0035 0.012 0.0297
Brugia malayi CHE-14 protein 0.0109 0.1046 0.3479
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.0893 0.332
Schistosoma mansoni serine/threonine kinase 0.0035 0.012 0.0297
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0054 0.0133
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0305 0.352 1
Mycobacterium ulcerans hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase 0.0264 0.3006 0.4535
Echinococcus multilocularis RNA directed DNA polymerase 0.0159 0.1683 0.1683
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.0893 0.332
Schistosoma mansoni serine/threonine protein kinase 0.0065 0.0492 0.1215
Chlamydia trachomatis AMP nucleosidase 0.0026 0 0.5
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0059 0.0419 0.1189
Echinococcus granulosus geminin 0.0347 0.4052 1
Giardia lamblia 3-hydroxy-3-methylglutaryl-coenzyme A reductase 0.0124 0.1237 1
Schistosoma mansoni serine/threonine protein kinase 0.0035 0.012 0.0297
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0215 0.061
Trichomonas vaginalis AGC family protein kinase 0.0035 0.012 0.0447
Mycobacterium tuberculosis Probable oxidoreductase 0.0552 0.6628 1
Trypanosoma brucei protein kinase, putative 0.0059 0.0419 0.1189
Schistosoma mansoni atypical protein kinase C 0.006 0.0428 0.1057

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 1.48 uM Inhibition of GSK3beta (unknown origin) assessed as breakdown of glycogen synthase derived substrate peptide by ADP hunter assay in presence of 100 uM ATP ChEMBL. 18502121
IC50 (binding) = 1.48 uM Inhibition of GSK3beta (unknown origin) assessed as breakdown of glycogen synthase derived substrate peptide by ADP hunter assay in presence of 100 uM ATP ChEMBL. 18502121

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

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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