Detailed information for compound 512487

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 353.173 | Formula: C16H9BrN4O
  • H donors: 2 H acceptors: 3 LogP: 2.27 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#Cc1ccc2c(c1)c1CC(=O)Nc3c(c1[nH]2)nc(Br)cc3
  • InChi: 1S/C16H9BrN4O/c17-13-4-3-12-16(21-13)15-10(6-14(22)19-12)9-5-8(7-18)1-2-11(9)20-15/h1-5,20H,6H2,(H,19,22)
  • InChiKey: HSNASFPPYVOOEC-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
Homo sapiens cyclin-dependent kinase 5 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma congolense cdc2-related kinase 3, putative Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium berghei cdc2-related kinase 2 Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus cyclin dependent kinase 5 Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) CMGC/GSK protein kinase 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
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania donovani cell division protein kinase 2 Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis protein kinase shaggy Get druggable targets OG5_126888 All targets in OG5_126888
Candida albicans hypothetical protein 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
Plasmodium knowlesi glycogen synthase kinase 3, 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
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania donovani cdc2-related kinase 3, putative Get druggable targets OG5_126712 All targets in OG5_126712
Onchocerca volvulus 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
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium yoelii Protein kinase domain, putative Get druggable targets OG5_126888 All targets in OG5_126888
Entamoeba histolytica cell division protein kinase 2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium vivax protein kinase Crk2 Get druggable targets OG5_126712 All targets in OG5_126712
Candida albicans Serine/threonine protein kinase required for induction of IME2 by Ime1p Get druggable targets OG5_126888 All targets in OG5_126888
Giardia lamblia Kinase, CMGC CDK Get druggable targets OG5_126712 All targets in OG5_126712
Giardia lamblia Kinase, CMGC GSK Get druggable targets OG5_126888 All targets in OG5_126888
Cryptosporidium parvum hypothetical protein Get druggable targets OG5_126888 All targets in OG5_126888
Trypanosoma brucei gambiense cell division protein kinase 2 homolog 1,cdc2- like protein kinase, putative Get druggable targets OG5_126712 All targets in OG5_126712
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
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126888 All targets in OG5_126888
Echinococcus granulosus cyclin dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Theileria parva cell division control protein 2 related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Cryptosporidium hominis cdc2-like protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma brucei gambiense protein kinase, putative,glycogen synthase kinase, putative 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 vivax glycogen synthase kinase 3, putative 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
Entamoeba histolytica protein kinase, putative Get druggable targets OG5_126888 All targets in OG5_126888
Leishmania mexicana cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) Get druggable targets OG5_126888 All targets in OG5_126888
Trypanosoma brucei gambiense cell division related protein kinase 2, putative,CDC2-related protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative Get druggable targets OG5_126888 All targets in OG5_126888
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania braziliensis cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Cryptosporidium hominis hypothetical protein 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
Trypanosoma cruzi cdc2-related kinase 3 Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma japonicum ko:K02087 cyclin-dependent kinase 1, putative Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania infantum glycogen synthase kinase 3 Get druggable targets OG5_126888 All targets in OG5_126888
Trypanosoma cruzi cdc2-related kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium falciparum protein kinase 5 Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium yoelii cdc2-related kinase 2 Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania mexicana cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus protein kinase shaggy Get druggable targets OG5_126888 All targets in OG5_126888
Schistosoma japonicum ko:K02090 cyclin-dependent kinase 5, putative Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania major cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma brucei cdc2-related kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania infantum cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium berghei glycogen synthase kinase 3, putative 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
Leishmania major cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium knowlesi Cell division control protein 2 homolog Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma japonicum ko:K08822 glycogen synthase kinase 3 alpha, putative Get druggable targets OG5_126888 All targets in OG5_126888
Trypanosoma congolense cdc2-related kinase 1, putative Get druggable targets OG5_126712 All targets in OG5_126712
Theileria parva glycogen synthase kinase, putative Get druggable targets OG5_126888 All targets in OG5_126888
Leishmania braziliensis cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Candida albicans Protein kinase that can substitute for S. cerevisiae CDC28 (YBR160W) main cell cycle cyclin-dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Entamoeba histolytica protein kinase domain containing protein Get druggable targets OG5_126888 All targets in OG5_126888
Trypanosoma brucei cdc2-related kinase 3 Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma cruzi cdc2-related kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Entamoeba histolytica cell division protein kinase 2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Babesia bovis protein kinase domain containing protein 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
Echinococcus multilocularis cyclin dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126888 All targets in OG5_126888
Babesia bovis cell division control protein 2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Neospora caninum CMGC kinase, CDK family TgPK2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Giardia lamblia Kinase, CMGC CDK Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium falciparum glycogen synthase kinase 3 Get druggable targets OG5_126888 All targets in OG5_126888
Cryptosporidium parvum Cdc2-like CDK2/CDC28 like protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Candida albicans Protein kinase that can substitute for S. cerevisiae CDC28 (YBR160W) main cell cycle cyclin-dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Neospora caninum hypothetical protein Get druggable targets OG5_126888 All targets in OG5_126888
Leishmania infantum cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis cyclin dependent kinase 5 Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma cruzi glycogen synthase kinase 3, putative 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
Brugia malayi Protein kinase domain containing protein Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma cruzi cdc2-related kinase 3 Get druggable targets OG5_126712 All targets in OG5_126712
Brugia malayi intracellular kinase 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
Brugia malayi cell division control protein 2 homolog Get druggable targets OG5_126712 All targets in OG5_126712
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Trypanosoma brucei mitogen-activated protein kinase 5 cyclin-dependent kinase 5 260 aa 307 aa 28.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Entamoeba histolytica protein kinase domain containing protein 0.0059 0.1822 1
Loa Loa (eye worm) hypothetical protein 0.0005 0.0028 0.0028
Onchocerca volvulus 0.023 0.7572 0.757
Trichomonas vaginalis set domain proteins, putative 0.023 0.7572 1
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0009 0.0141 0.0726
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.0732 0.1002
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0183 0.0174
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.0826 0.3148
Brugia malayi Nuclear hormone receptor-like 1 0.0005 0.0028 0.0026
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0183 0.096
Loa Loa (eye worm) hypothetical protein 0.001 0.0183 0.0263
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0183 0.0263
Echinococcus granulosus protein kinase shaggy 0.0059 0.1822 1
Trichomonas vaginalis DNA helicase recq1, putative 0.0021 0.0549 0.0441
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0059 0.1822 0.2735
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0183 0.0241
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0183 0.0241
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0053 0.1623 0.2435
Loa Loa (eye worm) hypothetical protein 0.001 0.0183 0.0263
Trichomonas vaginalis CMGC family protein kinase 0.0059 0.1822 0.2173
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.1623 0.1902
Loa Loa (eye worm) intermediate filament protein 0.0026 0.0732 0.1092
Brugia malayi ecdysteroid receptor 0.001 0.0183 0.0241
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0183 0.096
Loa Loa (eye worm) hypothetical protein 0.0012 0.0262 0.0381
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0183 0.0263
Brugia malayi Pre-SET motif family protein 0.0202 0.6635 0.9178
Brugia malayi Telomerase reverse transcriptase 0.022 0.7229 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0183 0.096
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0183 0.0174
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0059 0.1822 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0183 0.0241
Echinococcus granulosus lamin dm0 0.0026 0.0732 0.3991
Loa Loa (eye worm) hypothetical protein 0.001 0.0183 0.0263
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0183 0.096
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0009 0.0141 0.0726
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0183 0.096
Brugia malayi Protein kinase domain containing protein 0.0053 0.1623 0.2235
Loa Loa (eye worm) hypothetical protein 0.001 0.0183 0.0263
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0183 0.096
Schistosoma mansoni intermediate filament proteins 0.0026 0.0732 0.3991
Giardia lamblia Kinase, CMGC CDK 0.0053 0.1623 0.5965
Loa Loa (eye worm) hypothetical protein 0.0005 0.0028 0.0028
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.1623 0.8902
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0183 0.0241
Plasmodium vivax glycogen synthase kinase 3, putative 0.0059 0.1822 0.6509
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0183 0.0241
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0183 0.0241
Onchocerca volvulus 0.0026 0.0732 0.0724
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.0826 0.4509
Trypanosoma cruzi cdc2-related kinase 1 0.0053 0.1623 0.5823
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0014 0.0324 0.0476
Loa Loa (eye worm) hypothetical protein 0.001 0.0183 0.0263
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0183 0.0263
Echinococcus multilocularis musashi 0.0026 0.0732 0.3991
Trypanosoma brucei protein kinase, putative 0.0059 0.1822 0.6653
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0826 0.4509
Trichomonas vaginalis CMGC family protein kinase 0.0059 0.1822 0.2173
Echinococcus multilocularis cyclin dependent kinase 5 0.0053 0.1623 0.8902
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0183 0.0174
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0005 0.0028 0.0103
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0183 0.096
Giardia lamblia Kinase, CMGC GSK 0.0059 0.1822 0.6766
Loa Loa (eye worm) hypothetical protein 0.0005 0.0028 0.0028
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0009 0.0141 0.0726
Onchocerca volvulus 0.0026 0.0732 0.0724
Echinococcus multilocularis cyclin dependent kinase 0.0053 0.1623 0.8902
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0053 0.1623 0.8902
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0183 0.096
Echinococcus multilocularis cyclin dependent kinase 1 0.0053 0.1623 0.8902
Brugia malayi steroid hormone receptor 0.001 0.0183 0.0241
Echinococcus multilocularis lamin 0.0026 0.0732 0.3991
Echinococcus granulosus lamin 0.0026 0.0732 0.3991
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0826 0.4509
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.1623 0.1902
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0005 0.0028 0.0103
Brugia malayi hypothetical protein 0.0005 0.0028 0.0026
Brugia malayi cell division control protein 2 homolog 0.0053 0.1623 0.2235
Echinococcus multilocularis bloom syndrome protein 0.0021 0.0549 0.2979
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.0826 0.4509
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0183 0.096
Schistosoma mansoni lamin 0.0026 0.0732 0.3991
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0183 0.0241
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0009 0.0141 0.0182
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0183 0.0241
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0009 0.0141 0.0182
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0183 0.0241
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0183 0.0263
Loa Loa (eye worm) hypothetical protein 0.0009 0.0141 0.0199
Brugia malayi intracellular kinase 0.0059 0.1822 0.2511
Echinococcus granulosus cyclin dependent kinase 0.0053 0.1623 0.8902
Schistosoma mansoni coup transcription factor 0.001 0.0183 0.096
Loa Loa (eye worm) hypothetical protein 0.001 0.0183 0.0263
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0183 0.0263
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0183 0.096
Schistosoma mansoni DNA helicase recq5 0.0009 0.0141 0.0726
Plasmodium vivax protein kinase Crk2 0.0053 0.1623 0.5644
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0013 0.0278 0.1483
Trypanosoma brucei cdc2-related kinase 3 0.0053 0.1623 0.5823
Brugia malayi Bloom's syndrome protein homolog 0.0021 0.0549 0.0748
Onchocerca volvulus 0.0059 0.1822 0.1814
Trypanosoma cruzi cdc2-related kinase 3 0.0053 0.1623 0.5823
Schistosoma mansoni hypothetical protein 0.005 0.1539 0.844
Echinococcus granulosus cyclin dependent kinase 1 0.0053 0.1623 0.8902
Echinococcus granulosus intermediate filament protein 0.0026 0.0732 0.3991
Entamoeba histolytica protein kinase domain containing protein 0.0059 0.1822 1
Giardia lamblia Kinase, CMGC GSK 0.0059 0.1822 0.6766
Plasmodium vivax telomerase reverse transcriptase, putative 0.0082 0.2625 1
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0183 0.096
Echinococcus multilocularis cyclin dependent kinase 1 0.0053 0.1623 0.8902
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0183 0.0263
Schistosoma mansoni nuclear hormone receptor 0.001 0.0183 0.096
Onchocerca volvulus 0.001 0.0183 0.0174
Trypanosoma cruzi cdc2-related kinase 1 0.0053 0.1623 0.5823
Plasmodium falciparum glycogen synthase kinase 3 0.0059 0.1822 0.6766
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0059 0.1822 0.2735
Loa Loa (eye worm) hypothetical protein 0.0012 0.0262 0.0381
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0082 0.2625 1
Echinococcus granulosus FTZ F1 alpha 0.001 0.0183 0.096
Trichomonas vaginalis DNA helicase recq, putative 0.0021 0.0549 0.0441
Schistosoma mansoni thyroid hormone receptor 0.001 0.0183 0.096
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0183 0.0241
Schistosoma mansoni thyroid hormone receptor 0.001 0.0183 0.096
Trypanosoma brucei cdc2-related kinase 1 0.0053 0.1623 0.5823
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0183 0.0241
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0202 0.6635 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0183 0.096
Toxoplasma gondii RNA-directed DNA polymerase 0.0082 0.2625 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0732 0.1092
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0009 0.0141 0.0726
Brugia malayi nuclear hormone receptor 0.001 0.0183 0.0241
Entamoeba histolytica cell division protein kinase 2, putative 0.0053 0.1623 0.8907
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0826 0.4509
Giardia lamblia Kinase, CMGC CDK 0.0053 0.1623 0.5965
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.0826 0.4509
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0059 0.1822 1
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0005 0.0028 0.0028
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0053 0.1623 0.2435
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0183 0.096
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0183 0.096
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0183 0.0263
Onchocerca volvulus 0.0029 0.0826 0.0818
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0014 0.0318 0.1212
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0009 0.0141 0.0536
Trypanosoma cruzi cdc2-related kinase 3 0.0053 0.1623 0.5823
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0018 0.0465 0.1304
Giardia lamblia Telomerase catalytic subunit 0.0082 0.2625 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0826 0.1234
Echinococcus granulosus bloom syndrome protein 0.0021 0.0549 0.2979
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.1623 0.1902
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0009 0.0141 0.0199
Brugia malayi Nuclear hormone receptor-like 1 0.0005 0.0028 0.0026
Loa Loa (eye worm) hypothetical protein 0.0026 0.0716 0.1067
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0183 0.0241
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0059 0.1822 0.6653
Schistosoma mansoni DNA helicase recq1 0.0009 0.0141 0.0726
Echinococcus multilocularis protein kinase shaggy 0.0059 0.1822 1
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0826 0.4509
Brugia malayi nuclear receptor RXR 0.0005 0.0028 0.0026
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0009 0.0141 0.0536
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0183 0.0263
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0183 0.0241
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0082 0.2625 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.0732 0.1092
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0183 0.096
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0183 0.0241
Entamoeba histolytica recQ family helicase, putative 0.0011 0.0225 0.1236
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0183 0.096
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0183 0.096
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0183 0.096
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0053 0.1623 0.2435
Plasmodium vivax SET domain protein, putative 0.0029 0.0826 0.2184
Loa Loa (eye worm) hypothetical protein 0.0013 0.0278 0.0406
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0183 0.096
Loa Loa (eye worm) hypothetical protein 0.0005 0.0028 0.0028
Brugia malayi Pre-SET motif family protein 0.0029 0.0826 0.1132
Loa Loa (eye worm) hypothetical protein 0.0017 0.0408 0.0602
Loa Loa (eye worm) hypothetical protein 0.001 0.0183 0.0263
Plasmodium falciparum telomerase reverse transcriptase 0.0082 0.2625 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0183 0.0263
Brugia malayi nuclear receptor NHR-88 0.001 0.0183 0.0241
Loa Loa (eye worm) hypothetical protein 0.0052 0.1585 0.2379
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0183 0.0241
Schistosoma mansoni blooms syndrome DNA helicase 0.0016 0.0403 0.2172
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0183 0.096
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0005 0.0028 0.0103
Brugia malayi hypothetical protein 0.0005 0.0028 0.0026
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0059 0.1822 1
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0183 0.096
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0059 0.1822 0.694
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0053 0.1623 0.5823
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0183 0.096
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.1623 0.8902
Brugia malayi cytoplasmic intermediate filament protein 0.0014 0.0324 0.0437
Echinococcus granulosus cyclin dependent kinase 5 0.0053 0.1623 0.8902
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0183 0.096
Brugia malayi intermediate filament protein 0.0026 0.0732 0.1002
Trypanosoma brucei telomerase reverse transcriptase 0.0082 0.2625 1
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0013 0.0278 0.1483
Entamoeba histolytica protein kinase, putative 0.0059 0.1822 1
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0183 0.096
Loa Loa (eye worm) hypothetical protein 0.0005 0.0028 0.0028
Loa Loa (eye worm) RecQ helicase 0.0021 0.0549 0.0815
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0005 0.0028 0.0103
Plasmodium falciparum protein kinase 5 0.0053 0.1623 0.5965
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0791 0.4312
Echinococcus multilocularis lamin dm0 0.0026 0.0732 0.3991
Schistosoma mansoni lamin 0.0026 0.0732 0.3991
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0053 0.1623 0.5823
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0183 0.0241
Entamoeba histolytica cell division protein kinase 2, putative 0.0053 0.1623 0.8907
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0183 0.096
Leishmania major telomerase reverse transcriptase, putative 0.0082 0.2625 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0183 0.096
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0059 0.1822 0.6653
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0053 0.1623 0.6181

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 3.8 uM Inhibition of GSK3alpha/beta in pig brain ChEMBL. 18345612
IC50 (binding) = 3.8 uM Inhibition of GSK3alpha/beta in pig brain ChEMBL. 18345612
IC50 (binding) = 10 uM Inhibition of recombinant CDK5/p25 (unknown origin) expressed in Escherichia coli ChEMBL. 18345612
IC50 (binding) = 10 uM Inhibition of starfish CDK1/cyclin B ChEMBL. 18345612
IC50 (binding) = 10 uM Inhibition of recombinant CDK5/p25 (unknown origin) expressed in Escherichia coli ChEMBL. 18345612

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

1 literature reference was collected for this gene.

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