Detailed information for compound 1667247

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 385.422 | Formula: C21H19N7O
  • H donors: 1 H acceptors: 4 LogP: 2.35 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#Cc1cnn2c1nc(cc2NC1CC1)n1ccc2c1cc(cc2)N(C(=O)C)C
  • InChi: 1S/C21H19N7O/c1-13(29)26(2)17-6-3-14-7-8-27(18(14)9-17)19-10-20(24-16-4-5-16)28-21(25-19)15(11-22)12-23-28/h3,6-10,12,16,24H,4-5H2,1-2H3
  • InChiKey: LEBFBYRNCKITGV-UHFFFAOYSA-N  


Substructure search Similarity search

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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 homeodomain interacting protein kinase 2 Starlite/ChEMBL References
Homo sapiens glycogen synthase kinase 3 beta Starlite/ChEMBL References
Homo sapiens casein kinase 2, alpha 1 polypeptide Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Neospora caninum hypothetical protein Get druggable targets OG5_126901 All targets in OG5_126901
Candida albicans hypothetical protein Get druggable targets OG5_129272 All targets in OG5_129272
Leishmania braziliensis protein kinase, putative,glycogen synthase kinase, putative Get druggable targets OG5_126888 All targets in OG5_126888
Leishmania donovani casein kinase II, putative Get druggable targets OG5_126901 All targets in OG5_126901
Theileria parva casein kinase II, alpha chain Get druggable targets OG5_126901 All targets in OG5_126901
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_126901 All targets in OG5_126901
Toxoplasma gondii CMGC kinase, CK2 family Get druggable targets OG5_126901 All targets in OG5_126901
Plasmodium yoelii Protein kinase domain, putative Get druggable targets OG5_126888 All targets in OG5_126888
Schistosoma japonicum expressed protein Get druggable targets OG5_129272 All targets in OG5_129272
Schistosoma mansoni protein kinase Get druggable targets OG5_126901 All targets in OG5_126901
Leishmania major casein kinase II, putative Get druggable targets OG5_126901 All targets in OG5_126901
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126901 All targets in OG5_126901
Candida albicans Serine/threonine protein kinase required for induction of IME2 by Ime1p Get druggable targets OG5_126888 All targets in OG5_126888
Trypanosoma congolense casein kinase II, putative Get druggable targets OG5_126901 All targets in OG5_126901
Entamoeba histolytica protein kinase domain containing protein Get druggable targets OG5_126901 All targets in OG5_126901
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126901 All targets in OG5_126901
Echinococcus granulosus glycogen synthase kinase 3 beta Get druggable targets OG5_126888 All targets in OG5_126888
Loa Loa (eye worm) CMGC/DYRK/HIPK protein kinase Get druggable targets OG5_129272 All targets in OG5_129272
Entamoeba histolytica casein kinase, putative Get druggable targets OG5_126901 All targets in OG5_126901
Schistosoma japonicum ko:K03097 casein kinase 2, alpha polypeptide, putative Get druggable targets OG5_126901 All targets in OG5_126901
Echinococcus multilocularis protein kinase shaggy 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
Loa Loa (eye worm) CMGC/CK2 protein kinase Get druggable targets OG5_126901 All targets in OG5_126901
Leishmania donovani glycogen synthase kinase 3, 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
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126901 All targets in OG5_126901
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126888 All targets in OG5_126888
Schistosoma japonicum ko:K08826 homeodomain interacting protein kinase, putative Get druggable targets OG5_129272 All targets in OG5_129272
Giardia lamblia Kinase, CMGC GSK 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
Candida albicans hypothetical protein Get druggable targets OG5_126888 All targets in OG5_126888
Trypanosoma brucei gambiense casein kinase II, putative Get druggable targets OG5_126901 All targets in OG5_126901
Onchocerca volvulus 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
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 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
Entamoeba histolytica protein kinase, 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 vivax glycogen synthase kinase 3, putative 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
Candida albicans likely protein kinase similar to S. cerevisiae CKA1 (YIL035C) alpha subunit of protein kinase 2, aka casein kinase II Get druggable targets OG5_126901 All targets in OG5_126901
Trypanosoma cruzi glycogen synthase kinase 3, putative Get druggable targets OG5_126888 All targets in OG5_126888
Echinococcus multilocularis casein kinase ii subunit alpha Get druggable targets OG5_126901 All targets in OG5_126901
Trypanosoma brucei gambiense protein kinase, putative,glycogen synthase kinase, putative Get druggable targets OG5_126888 All targets in OG5_126888
Candida albicans Casein kinase II alpha' subunit Get druggable targets OG5_126901 All targets in OG5_126901
Neospora caninum 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
Cryptosporidium hominis hypothetical protein Get druggable targets OG5_126888 All targets in OG5_126888
Leishmania infantum casein kinase II, putative Get druggable targets OG5_126901 All targets in OG5_126901
Plasmodium falciparum casein kinase 2, alpha subunit Get druggable targets OG5_126901 All targets in OG5_126901
Echinococcus multilocularis homeodomain interacting protein kinase 3 Get druggable targets OG5_129272 All targets in OG5_129272
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 Get druggable targets OG5_126888 All targets in OG5_126888
Leishmania braziliensis casein kinase II, putative Get druggable targets OG5_126901 All targets in OG5_126901
Cryptosporidium parvum hypothetical protein Get druggable targets OG5_126888 All targets in OG5_126888
Candida albicans similar to C terminus of S. cerevisiae YAK1 (YJL141C) serine-threonine protein kinase Get druggable targets OG5_129272 All targets in OG5_129272
Brugia malayi intracellular kinase Get druggable targets OG5_126888 All targets in OG5_126888
Candida albicans Casein kinase II alpha' subunit Get druggable targets OG5_126901 All targets in OG5_126901
Brugia malayi Casein kinase II, alpha chain Get druggable targets OG5_126901 All targets in OG5_126901
Brugia malayi Homeodomain interacting protein kinase protein 1 Get druggable targets OG5_129272 All targets in OG5_129272
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative Get druggable targets OG5_126888 All targets in OG5_126888
Babesia bovis casein kinase II, alpha chain (CK II) Get druggable targets OG5_126901 All targets in OG5_126901
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126901 All targets in OG5_126901
Plasmodium knowlesi casein kinase 2, alpha subunit, putative Get druggable targets OG5_126901 All targets in OG5_126901
Babesia bovis protein kinase domain containing protein Get druggable targets OG5_126888 All targets in OG5_126888
Candida albicans hypothetical protein Get druggable targets OG5_129272 All targets in OG5_129272
Echinococcus granulosus homeodomain interacting protein kinase 3 Get druggable targets OG5_129272 All targets in OG5_129272
Candida albicans similar to C terminus of S. cerevisiae YAK1 (YJL141C) serine-threonine protein kinase Get druggable targets OG5_129272 All targets in OG5_129272
Echinococcus granulosus casein kinase ii subunit alpha Get druggable targets OG5_126901 All targets in OG5_126901
Entamoeba histolytica protein kinase domain containing protein Get druggable targets OG5_129272 All targets in OG5_129272
Plasmodium vivax unspecified product Get druggable targets OG5_126901 All targets in OG5_126901
Plasmodium berghei casein kinase 2, alpha subunit Get druggable targets OG5_126901 All targets in OG5_126901
Echinococcus multilocularis glycogen synthase kinase 3 beta Get druggable targets OG5_126888 All targets in OG5_126888
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126901 All targets in OG5_126901
Giardia lamblia Kinase, CMGC CK2 Get druggable targets OG5_126901 All targets in OG5_126901
Candida albicans second truncated form of RIM11 Serine/threonine protein kinase 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
Entamoeba histolytica 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_126901 All targets in OG5_126901
Trypanosoma brucei protein kinase, 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
Leishmania mexicana protein kinase, putative,glycogen synthase 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
Trypanosoma brucei Casein kinase II Get druggable targets OG5_126901 All targets in OG5_126901
Loa Loa (eye worm) CMGC/GSK protein kinase Get druggable targets OG5_126888 All targets in OG5_126888
Cryptosporidium parvum casein kinase II, alpha subunit, putative Get druggable targets OG5_126901 All targets in OG5_126901
Leishmania mexicana casein kinase II, putative Get druggable targets OG5_126901 All targets in OG5_126901
Plasmodium yoelii Protein kinase domain Get druggable targets OG5_126901 All targets in OG5_126901
Trypanosoma cruzi casein kinase II, putative Get druggable targets OG5_126901 All targets in OG5_126901
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_129272 All targets in OG5_129272
Leishmania infantum glycogen synthase kinase 3 Get druggable targets OG5_126888 All targets in OG5_126888
Plasmodium vivax casein kinase 2, alpha subunit, putative Get druggable targets OG5_126901 All targets in OG5_126901
Cryptosporidium hominis protein kinase domain Get druggable targets OG5_126901 All targets in OG5_126901
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Trypanosoma cruzi casein kinase II, alpha chain, putative casein kinase 2, alpha 1 polypeptide 391 aa 316 aa 51.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.0213
Trypanosoma cruzi Endonuclease/Exonuclease/phosphatase family, putative 0.0009 0.0112 0.0366
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0059 0.2055 0.2669
Schistosoma mansoni hypothetical protein 0.0013 0.0266 0.034
Schistosoma mansoni 60S ribosomal protein L21 0.0007 0.0049 0.0057
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.1378 0.4667
Entamoeba histolytica protein kinase domain containing protein 0.0205 0.7688 1
Trypanosoma brucei cyclic nucleotide-binding domain containing protein, putative 0.0006 0.0005 0.0016
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0009 0.0112 0.0366
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.0213
Echinococcus granulosus hyperpolarization activated cyclic 0.0009 0.0117 0.0147
Echinococcus granulosus protein kinase shaggy 0.0059 0.2055 0.2669
Trichomonas vaginalis helicase, putative 0.0008 0.0067 0.0213
Echinococcus granulosus inositol polyphosphate 5 phosphatase OCRL 1 0.0009 0.0112 0.014
Trichomonas vaginalis skeletal muscle/kidney enriched inositol 5-phosphatase, putative 0.0009 0.0112 0.0366
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0009 0.0112 0.014
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0042 0.1378 0.961
Schistosoma mansoni ap endonuclease 0.0043 0.1434 0.186
Brugia malayi beta-lactamase 0.0042 0.1378 0.1788
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0067 0.0213
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.0213
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0059 0.2055 0.2669
Onchocerca volvulus 0.0033 0.1054 0.5119
Echinococcus multilocularis cyclic nucleotide gated cation channel alpha 3 0.0009 0.0117 0.0147
Leishmania major hypothetical protein, conserved 0.0009 0.0112 0.0366
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0009 0.0117 0.0147
Leishmania major pantothenate kinase subunit, putative 0.0009 0.0112 0.0366
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0009 0.0117 0.0147
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.0213
Echinococcus multilocularis inositol polyphosphate 5 phosphatase OCRL 1 0.0009 0.0112 0.014
Echinococcus granulosus hyperpolarization activated cyclic 0.0009 0.0117 0.0147
Trichomonas vaginalis ocrl type II inositol 5-phosphatase, putative 0.0009 0.0112 0.0366
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0009 0.0112 0.014
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0009 0.0112 0.014
Echinococcus granulosus voltage gated potassium channel 0.0013 0.0275 0.0352
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0009 0.0117 0.0147
Schistosoma mansoni serine/threonine protein kinase 0.0008 0.0069 0.0084
Brugia malayi beta-lactamase family protein 0.0042 0.1378 0.1788
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0173 0.0219
Loa Loa (eye worm) CXXC zinc finger family protein 0.0033 0.1054 0.1366
Trypanosoma cruzi casein kinase II, putative 0.0082 0.2948 1
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.1378 0.4667
Trichomonas vaginalis ap endonuclease, putative 0.0043 0.1434 0.4856
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0009 0.0112 0.0366
Echinococcus multilocularis cpg binding protein 0.0035 0.1127 0.1461
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0009 0.0112 0.014
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.0213
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0008 0.0095 0.0118
Entamoeba histolytica casein kinase, putative 0.0082 0.2948 0.3743
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.0213
Leishmania major endonuclease/exonuclease protein-like protein 0.0009 0.0112 0.0366
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0013 0.0275 0.0352
Trypanosoma cruzi pantothenate kinase subunit, putative 0.0009 0.0112 0.0366
Trichomonas vaginalis esterase, putative 0.0042 0.1378 0.4667
Plasmodium vivax casein kinase 2, alpha subunit, putative 0.0082 0.2948 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0042 0.1378 0.1788
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0009 0.0117 0.0147
Echinococcus granulosus casein kinase ii subunit alpha 0.0082 0.2948 0.383
Plasmodium falciparum carbon catabolite repressor protein 4, putative 0.0009 0.0112 0.0366
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0059 0.2055 0.6968
Mycobacterium ulcerans hypothetical protein 0.0042 0.1378 0.961
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0059 0.2055 0.2669
Loa Loa (eye worm) hypothetical protein 0.0042 0.1378 0.1788
Trypanosoma brucei protein kinase A regulatory subunit 0.0006 0.0005 0.0016
Onchocerca volvulus Putative neutral sphingomyelinase 0.0009 0.0112 0.0526
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0043 0.1434 0.4856
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0866 0.2927
Schistosoma mansoni voltage-gated potassium channel 0.0013 0.0275 0.0352
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0009 0.0112 0.0366
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0009 0.0112 0.0366
Echinococcus granulosus traf and tnf receptor associated protein 0.0009 0.0112 0.014
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0866 0.2927
Plasmodium falciparum casein kinase 2, alpha subunit 0.0082 0.2948 1
Schistosoma mansoni ocrl type II inositol 5-phosphatase 0.0009 0.0112 0.014
Trichomonas vaginalis CMGC family protein kinase 0.0082 0.2948 1
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0009 0.0112 0.014
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0042 0.1378 0.1374
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.1378 0.4667
Entamoeba histolytica protein kinase domain containing protein 0.0082 0.2948 0.3743
Echinococcus multilocularis protein kinase shaggy 0.0059 0.2055 0.2669
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0009 0.0112 0.0366
Plasmodium falciparum glycogen synthase kinase 3 0.0059 0.2055 0.6968
Onchocerca volvulus 0.0042 0.1378 0.6698
Echinococcus multilocularis neutral sphingomyelinase 0.0009 0.0112 0.014
Echinococcus granulosus mixed lineage leukemia protein mll 0.0008 0.0095 0.0118
Leishmania major casein kinase II, putative 0.0082 0.2948 1
Mycobacterium tuberculosis Probable hydrolase 0.0042 0.1378 0.1374
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.0213
Echinococcus granulosus homeodomain interacting protein kinase 3 0.0205 0.7688 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0009 0.0112 0.0366
Brugia malayi CXXC zinc finger family protein 0.0033 0.1054 0.1366
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.0213
Schistosoma mansoni serine/threonine protein kinase 0.0205 0.7688 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.1378 0.1788
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0013 0.0266 0.034
Loa Loa (eye worm) hypothetical protein 0.0042 0.1378 0.1788
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0067 0.0213
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.0213
Loa Loa (eye worm) AGC/PKG protein kinase 0.0008 0.0069 0.0084
Plasmodium falciparum carbon catabolite repressor protein 4, putative 0.0009 0.0112 0.0366
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.1378 0.1788
Entamoeba histolytica protein kinase, putative 0.0059 0.2055 0.2565
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0043 0.1434 0.5
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0009 0.0112 0.014
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0009 0.0112 0.0366
Echinococcus multilocularis voltage gated potassium channel 0.0013 0.0275 0.0352
Loa Loa (eye worm) hypothetical protein 0.0009 0.0112 0.014
Onchocerca volvulus 0.0059 0.2055 1
Echinococcus granulosus potassium:sodium hyperpolarization activated 0.0009 0.0117 0.0147
Loa Loa (eye worm) histone methyltransferase 0.001 0.0173 0.0219
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.0213
Leishmania major hypothetical protein, conserved 0.0042 0.1378 0.4667
Leishmania major protein kinase, putative 0.0008 0.0069 0.0219
Trypanosoma cruzi Endonuclease/Exonuclease/phosphatase family, putative 0.0009 0.0112 0.0366
Toxoplasma gondii ABC1 family protein 0.0042 0.1378 0.4667
Entamoeba histolytica protein kinase domain containing protein 0.0059 0.2055 0.2565
Chlamydia trachomatis cAMP-dependent protein kinase regulatory subunit 0.0006 0.0005 0.5
Trypanosoma brucei Inositol phosphosphingolipids phospholipase C 0.0009 0.0112 0.0381
Schistosoma mansoni carbon catabolite repressor protein 0.0009 0.0112 0.014
Trypanosoma brucei inositol-1,4,5-trisphosphate (IP3) 5-phosphatase, putative 0.0009 0.0112 0.0381
Brugia malayi Egg laying defective protein 4 0.0008 0.0069 0.0084
Trichomonas vaginalis type IV inositol 5-phosphatase, putative 0.0009 0.0112 0.0366
Mycobacterium tuberculosis Probable lipase LipE 0.0042 0.1378 0.1374
Giardia lamblia Kinase, CMGC CK2 0.0082 0.2948 1
Plasmodium falciparum cGMP-dependent protein kinase 0.0008 0.0069 0.0219
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.0009 0.0117 0.0147
Mycobacterium tuberculosis Conserved protein 0.0042 0.1378 0.1374
Loa Loa (eye worm) hypothetical protein 0.0013 0.0275 0.0352
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.1378 0.4667
Leishmania major RNA-editing complex protein MP100, putative 0.0009 0.0112 0.0366
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0013 0.0275 0.0352
Echinococcus multilocularis deoxyribonuclease 1 2 0.0009 0.0112 0.014
Trichomonas vaginalis Phospholipase C precursor, putative 0.0009 0.0112 0.0366
Brugia malayi Cyclic-nucleotide gated cation channel 0.0009 0.0117 0.0147
Schistosoma mansoni serine/threonine protein kinase 0.0008 0.0069 0.0084
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0042 0.1378 0.1788
Trichomonas vaginalis CMGC family protein kinase 0.0059 0.2055 0.6968
Loa Loa (eye worm) CMGC/CK2 protein kinase 0.0082 0.2948 0.383
Trichomonas vaginalis type II inositol 5-phosphatase, putative 0.0009 0.0112 0.0366
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0009 0.0112 0.0366
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0008 0.0095 0.0118
Loa Loa (eye worm) hypothetical protein 0.0009 0.0112 0.014
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0045 0.1493 0.1938
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.0213
Leishmania major hypothetical protein, conserved 0.0009 0.0112 0.0366
Loa Loa (eye worm) beta-lactamase 0.0042 0.1378 0.1788
Brugia malayi intracellular kinase 0.0059 0.2055 0.2669
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0043 0.1434 0.4856
Schistosoma mansoni cpg binding protein 0.0035 0.1127 0.1461
Brugia malayi exodeoxyribonuclease III family protein 0.0043 0.1434 0.186
Brugia malayi hypothetical protein 0.0018 0.048 0.0619
Onchocerca volvulus 0.0009 0.0112 0.0526
Toxoplasma gondii CMGC kinase, CK2 family 0.0082 0.2948 1
Trypanosoma cruzi mitochondrial protein 99, putative 0.0009 0.0112 0.0366
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0009 0.0112 0.0366
Schistosoma mansoni voltage-gated potassium channel 0.0007 0.0049 0.0057
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0008 0.0069 0.0084
Trypanosoma brucei hypothetical protein, conserved 0.0042 0.1378 0.4675
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0043 0.1434 0.4856
Plasmodium falciparum endonuclease/exonuclease/phosphatase family protein, putative 0.0009 0.0112 0.0366
Leishmania major hypothetical protein, conserved 0.0028 0.0866 0.2927
Trichomonas vaginalis CMGC family protein kinase 0.0082 0.2948 1
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0045 0.1493 0.1938
Trypanosoma brucei Endonuclease/Exonuclease/phosphatase family, putative 0.0009 0.0112 0.0381
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0009 0.0112 0.0366
Loa Loa (eye worm) hypothetical protein 0.0009 0.0117 0.0147
Trichomonas vaginalis CMGC family protein kinase 0.0082 0.2948 1
Loa Loa (eye worm) CCR4-NOT transcription complex subunit 6 family protein 0.0009 0.0112 0.014
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.0213
Echinococcus multilocularis traf and tnf receptor associated protein 0.0009 0.0112 0.014
Trypanosoma brucei DNA-(apurinic or apyrimidinic site) lyase, putative 0.0009 0.0112 0.0381
Leishmania major protein kinase, putative 0.0008 0.0069 0.0219
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.1378 0.4667
Trypanosoma brucei Casein kinase II 0.0082 0.2948 1
Schistosoma mansoni cpg binding protein 0.0033 0.1054 0.1366
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0013 0.0275 0.0352
Schistosoma mansoni hypothetical protein 0.0009 0.0112 0.014
Toxoplasma gondii protein kinase G AGC kinase family member PKG 0.0008 0.0069 0.0219
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.0213
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0042 0.138 0.4675
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0043 0.1434 0.143
Trypanosoma brucei RNA editing exonuclease 2 0.0009 0.0112 0.0381
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0059 0.2055 0.2669
Giardia lamblia hypothetical protein 0.0009 0.0112 0.0366
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.0866 0.2938
Trypanosoma cruzi Endonuclease/Exonuclease/phosphatase family, putative 0.0009 0.0112 0.0366
Trypanosoma cruzi Endonuclease/Exonuclease/phosphatase family, putative 0.0009 0.0112 0.0366
Echinococcus granulosus cGMP dependent protein kinase 1 0.0008 0.0069 0.0084
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0043 0.1434 0.4856
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0009 0.0112 0.014
Trichomonas vaginalis CMGC family protein kinase 0.0082 0.2948 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0112 0.014
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0009 0.0112 0.0366
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0045 0.1493 0.1938
Schistosoma mansoni serine/threonine protein kinase 0.0008 0.0069 0.0084
Brugia malayi Homeodomain interacting protein kinase protein 1 0.0205 0.7688 1
Echinococcus granulosus neutral sphingomyelinase 0.0009 0.0112 0.014
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.0213
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0043 0.1434 0.4856
Mycobacterium tuberculosis Conserved protein 0.0042 0.1378 0.1374
Schistosoma mansoni mixed-lineage leukemia protein mll 0.007 0.2485 0.3229
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0866 0.2927
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0009 0.0112 0.014
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.0213
Plasmodium vivax hypothetical protein, conserved 0.0042 0.1378 0.4667
Trichomonas vaginalis sphingomyelinase C 2 precursor, putative 0.0009 0.0112 0.0366
Trichomonas vaginalis CMGC family protein kinase 0.0082 0.2948 1
Mycobacterium ulcerans beta-lactamase 0.0042 0.1378 0.961
Loa Loa (eye worm) hypothetical protein 0.0042 0.1378 0.1788
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0009 0.0112 0.014
Echinococcus multilocularis casein kinase ii subunit alpha 0.0082 0.2948 0.383
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0009 0.0117 0.0147
Schistosoma mansoni cript-related 0.0009 0.0112 0.014
Leishmania major inositol/phosphatidylinositol phosphatase, putative 0.0009 0.0112 0.0366
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0059 0.2055 0.6968
Mycobacterium tuberculosis Probable lipase LipD 0.0042 0.1378 0.1374
Schistosoma mansoni cpg binding protein 0.0035 0.1127 0.1461
Schistosoma mansoni voltage-gated potassium channel 0.0009 0.0117 0.0147
Echinococcus granulosus cGMP dependent protein kinase 1 0.0008 0.0069 0.0084
Treponema pallidum exodeoxyribonuclease (exoA) 0.0043 0.1434 1
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0009 0.0112 0.014
Plasmodium vivax endonuclease/exonuclease/phosphatase domain containing protein 0.0009 0.0112 0.0366
Schistosoma mansoni ap endonuclease 0.0043 0.1434 0.186
Trypanosoma cruzi endonuclease/exonuclease/phosphatase, putative 0.0009 0.0112 0.0366
Echinococcus multilocularis beta LACTamase domain containing family member 0.0042 0.1378 0.1788
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0008 0.0095 0.0118
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0009 0.0117 0.0383
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0008 0.0069 0.0084
Trypanosoma brucei Endonuclease/Exonuclease/phosphatase family, putative 0.0009 0.0112 0.0381
Schistosoma mansoni voltage-gated potassium channel 0.0013 0.0275 0.0352
Trichomonas vaginalis CMGC family protein kinase 0.0082 0.2948 1
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0042 0.1378 0.1374
Toxoplasma gondii exonuclease III APE 0.0043 0.1434 0.4856
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0009 0.0112 0.014
Mycobacterium ulcerans lipase LipD 0.0042 0.1378 0.961
Echinococcus granulosus CCR4 NOT transcription complex subunit 6 0.0009 0.0112 0.014
Trypanosoma cruzi mitochondrial protein 99, putative 0.0009 0.0112 0.0366
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0013 0.0266 0.034
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.1378 0.4667
Trichomonas vaginalis CMGC family protein kinase 0.0059 0.2055 0.6968
Onchocerca volvulus 0.0009 0.0112 0.0526
Plasmodium falciparum DNase I-like protein, putative 0.0009 0.0112 0.0366
Trypanosoma cruzi RNA-editing complex protein MP100, putative 0.0009 0.0112 0.0366
Loa Loa (eye worm) hypothetical protein 0.0042 0.1378 0.1788
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0043 0.1434 1
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0009 0.0112 0.014
Mycobacterium tuberculosis Probable esterase LipL 0.0042 0.1378 0.1374
Entamoeba histolytica protein kinase domain containing protein 0.0059 0.2055 0.2565
Giardia lamblia Kinase, CMGC GSK 0.0059 0.2055 0.6968
Schistosoma mansoni nocturnin 0.0009 0.0112 0.014
Brugia malayi Casein kinase II, alpha chain 0.0082 0.2948 0.383
Schistosoma mansoni neutral sphingomyelinase 0.0009 0.0112 0.014
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0009 0.0112 0.014
Trichomonas vaginalis ap endonuclease, putative 0.0043 0.1434 0.4856
Loa Loa (eye worm) CMGC/DYRK/HIPK protein kinase 0.0205 0.7688 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.1378 0.4667
Giardia lamblia Inositol 5-phosphatase 4 0.0009 0.0112 0.0366
Trypanosoma brucei cAMP response protein 1, putative 0.0006 0.0005 0.0016
Echinococcus multilocularis homeodomain interacting protein kinase 3 0.0205 0.7688 1
Trypanosoma brucei Endonuclease/Exonuclease/phosphatase family, putative 0.0009 0.0112 0.0381
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0009 0.0112 0.014
Echinococcus multilocularis hyperpolarization activated cyclic 0.0009 0.0117 0.0147
Brugia malayi hypothetical protein 0.0028 0.0866 0.1121
Loa Loa (eye worm) hypothetical protein 0.0039 0.1267 0.1643
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0009 0.0112 0.014
Mycobacterium tuberculosis Probable exported protein 0.0009 0.0112 0.0108
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0009 0.0117 0.0147
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0866 0.2927
Brugia malayi F/Y-rich N-terminus family protein 0.001 0.0168 0.0213
Trypanosoma brucei cAMP binding protein, putative 0.0006 0.0005 0.0016
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0866 0.2927
Leishmania major inositol phosphosphingolipid phospholipase C-Like 0.0009 0.0112 0.0366
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0866 0.2927
Loa Loa (eye worm) hypothetical protein 0.0028 0.0866 0.1121
Echinococcus multilocularis hyperpolarization activated cyclic 0.0009 0.0117 0.0147
Schistosoma mansoni protein kinase 0.0082 0.2948 0.383
Mycobacterium tuberculosis Conserved protein 0.0042 0.1378 0.1374
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0008 0.0095 0.0118
Trichomonas vaginalis CMGC family protein kinase 0.0082 0.2948 1
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0009 0.0112 0.0366
Trypanosoma brucei Flagellar Member 6 0.0006 0.0005 0.0016
Mycobacterium leprae Probable lipase LipE 0.0042 0.1378 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0045 0.1493 0.1938
Plasmodium vivax hypothetical protein, conserved 0.0009 0.0112 0.0366
Mycobacterium leprae conserved hypothetical protein 0.0042 0.1378 1
Trypanosoma brucei inositol/phosphatidylinositol phosphatase, putative 0.0009 0.0112 0.0381
Brugia malayi CCR4 0.0009 0.0112 0.014
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0043 0.1434 0.1744
Onchocerca volvulus 0.0042 0.1378 0.6698
Schistosoma mansoni synaptojanin 0.0009 0.0112 0.014
Onchocerca volvulus 0.0042 0.1378 0.6698
Trypanosoma cruzi inositol 5-phosphatase 1, putative 0.0009 0.0112 0.0366
Schistosoma mansoni synaptojanin 0.0009 0.0112 0.014
Trypanosoma cruzi Inositol phosphosphingolipids phospholipase C 0.0009 0.0112 0.0366
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0009 0.0117 0.0147
Echinococcus multilocularis expressed conserved protein 0.0008 0.0069 0.0084
Loa Loa (eye worm) hypothetical protein 0.0009 0.0112 0.014
Toxoplasma gondii histone lysine methyltransferase SET1 0.0063 0.2196 0.7446
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0043 0.1434 0.186
Plasmodium falciparum exodeoxyribonuclease III, putative 0.0009 0.0112 0.0366
Echinococcus granulosus cGMP dependent protein kinase 0.0008 0.0069 0.0084
Plasmodium vivax glycogen synthase kinase 3, putative 0.0059 0.2055 0.6968
Schistosoma mansoni voltage-gated potassium channel 0.0049 0.1651 0.2143
Leishmania major hypothetical protein, conserved 0.0009 0.0112 0.0366
Echinococcus multilocularis synaptojanin 1 0.0009 0.0112 0.014
Giardia lamblia Kinase, CMGC GSK 0.0059 0.2055 0.6968
Loa Loa (eye worm) hypothetical protein 0.0042 0.1378 0.1788
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0009 0.0117 0.0383
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0043 0.1434 0.186
Echinococcus granulosus cyclic nucleotide gated cation channel alpha 3 0.0009 0.0117 0.0147
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0009 0.0112 0.014
Brugia malayi beta-lactamase family protein 0.0042 0.1378 0.1788
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0043 0.1434 0.4856
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0059 0.2055 0.2669
Echinococcus granulosus beta LACTamase domain containing family member 0.0042 0.1378 0.1788
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0043 0.1434 0.4864
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0042 0.138 0.4675
Trypanosoma brucei cyclic nucleotide-binding domain containing protein, putative 0.0006 0.0005 0.0016
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0009 0.0117 0.0147
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0173 0.0219
Plasmodium vivax endonuclease/exonuclease/phosphatase domain containing protein 0.0009 0.0112 0.0366
Plasmodium vivax exodeoxyribonuclease III, putative 0.0009 0.0112 0.0366
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0009 0.0117 0.0147
Echinococcus multilocularis CCR4 NOT transcription complex subunit 6 0.0009 0.0112 0.014
Echinococcus granulosus synaptojanin 1 0.0009 0.0112 0.014
Trypanosoma brucei protein kinase, putative 0.0059 0.2055 0.6973
Mycobacterium ulcerans esterase/lipase LipP 0.0042 0.1378 0.961
Trypanosoma cruzi Endonuclease/Exonuclease/phosphatase family, putative 0.0009 0.0112 0.0366
Echinococcus multilocularis potassium:sodium hyperpolarization activated 0.0009 0.0117 0.0147
Treponema pallidum hypothetical protein 0.0009 0.0112 0.0754
Echinococcus granulosus cpg binding protein 0.0035 0.1127 0.1461
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0042 0.1378 0.1374
Schistosoma mansoni voltage-gated potassium channel 0.0049 0.1651 0.2143
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0059 0.2055 0.6968
Plasmodium vivax unspecified product 0.0082 0.2948 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0043 0.1434 0.186
Loa Loa (eye worm) hypothetical protein 0.0042 0.1378 0.1788

Activities

Activity type Activity value Assay description Source Reference
Fu (ADMET) = 2.5 % Fraction unbound in human plasma ChEMBL. 24900464
IC50 (binding) = 10 nM Inhibition of N-terminal His6X-tagged recombinant human full length casein kinase-2alpha expressed in SF21 cells using BODIPY-FL-RRRDDDSDDD-CONH2 as substrate preincubated for 20 mins measured after 90 mins by mobility shift assay ChEMBL. 24900749
IC50 (binding) < 0.003 uM Inhibition of HipK2 ChEMBL. 24900464
IC50 (binding) = 0.011 uM Inhibition of full length N-terminus His-tagged human CK2alpha expressed in insect Sf21 cells using BODIPY-FL-RRRDDDSDDD-CONH2 as substrate after 20 mins ChEMBL. 24900464
IC50 (binding) = 0.034 uM Inhibition of CK2alpha in human HCT116 cells assessed as decrease in AKT phosphorylation at S129 residue after 3 to 24 hrs by Western blot analysis ChEMBL. 24900464
IC50 (binding) = 1.4 uM Inhibition of GSK3beta ChEMBL. 24900464
IC50 (binding) > 30 uM Inhibition of CDK2 ChEMBL. 24900464

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

2 literature references were collected for this gene.

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