Detailed information for compound 1667744

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 490.541 | Formula: C24H25F3N4O2S
  • H donors: 2 H acceptors: 2 LogP: 3.95 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(Oc1cc(ccc1C(=O)N)c1cc(cnc1N)c1scc(c1)CN(C)C)/C=C\C(F)(F)F
  • InChi: 1S/C24H25F3N4O2S/c1-14(6-7-24(25,26)27)33-20-10-16(4-5-18(20)23(29)32)19-9-17(11-30-22(19)28)21-8-15(13-34-21)12-31(2)3/h4-11,13-14H,12H2,1-3H3,(H2,28,30)(H2,29,32)/b7-6-
  • InChiKey: LLEOOSLUHRQCHZ-SREVYHEPSA-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 polo-like kinase 1 Starlite/ChEMBL References
Homo sapiens NIMA-related kinase 2 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Plasmodium vivax NIMA-related protein kinase (Pfnek-1), putative Get druggable targets OG5_129446 All targets in OG5_129446
Leishmania major protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Plasmodium knowlesi NIMA related kinase 1, putative Get druggable targets OG5_129446 All targets in OG5_129446
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Giardia lamblia Kinase, NEK Get druggable targets OG5_129446 All targets in OG5_129446
Brugia malayi serine/threonine-protein kinase plk-2 Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Entamoeba histolytica serine/threonine protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Candida albicans protein serine/threonine kinase Get druggable targets OG5_127396 All targets in OG5_127396
Cryptosporidium parvum NEK2 protein, putative Get druggable targets OG5_129446 All targets in OG5_129446
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Loa Loa (eye worm) PLK/PLK1 protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Plasmodium falciparum NIMA related kinase 1 Get druggable targets OG5_129446 All targets in OG5_129446
Candida albicans likely protein kinase similar to S. cerevisiae KIN3 (YAR018C) Get druggable targets OG5_129446 All targets in OG5_129446
Schistosoma japonicum ko:K06631 polo-like kinase 1, putative Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus granulosus serine:threonine protein kinase PLK1 Get druggable targets OG5_127396 All targets in OG5_127396
Giardia lamblia Kinase, PLK Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma brucei gambiense polo-like protein kinase,protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma cruzi polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Cryptosporidium hominis NEK2 protein Get druggable targets OG5_129446 All targets in OG5_129446
Trichomonas vaginalis STE family protein kinase Get druggable targets OG5_129446 All targets in OG5_129446
Trypanosoma brucei polo-like protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania braziliensis protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis AGC family protein kinase Get druggable targets OG5_129446 All targets in OG5_129446
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Babesia bovis protein kinase domain containing protein Get druggable targets OG5_129446 All targets in OG5_129446
Neospora caninum MGC81305 protein, related Get druggable targets OG5_129446 All targets in OG5_129446
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma cruzi polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania mexicana protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Plasmodium yoelii NIMA-related protein kinase Get druggable targets OG5_129446 All targets in OG5_129446
Echinococcus multilocularis serine:threonine protein kinase PLK1 Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum Serine/threonine-protein kinase PLK1, putative Get druggable targets OG5_127396 All targets in OG5_127396
Giardia lamblia Kinase, NEK Get druggable targets OG5_129446 All targets in OG5_129446
Plasmodium berghei NIMA related kinase 1, putative Get druggable targets OG5_129446 All targets in OG5_129446
Theileria parva NIMA-related protein kinase, putative Get druggable targets OG5_129446 All targets in OG5_129446
Onchocerca volvulus Serine\/threonine kinase homolog Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Candida albicans protein serine/threonine kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma congolense protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Toxoplasma gondii NIMA-related protein kinase NIMA1 Get druggable targets OG5_129446 All targets in OG5_129446
Leishmania infantum protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Candida albicans likely protein kinase similar to S. cerevisiae KIN3 (YAR018C) Get druggable targets OG5_129446 All targets in OG5_129446
Giardia lamblia Kinase, NEK Get druggable targets OG5_129446 All targets in OG5_129446
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Giardia lamblia Kinase, NEK NIMA-related kinase 2 388 aa 312 aa 25.0 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0099 0.292 0.2827
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0061 0.1413 0.1301
Schistosoma mansoni growth factor receptor-bound protein 0.0043 0.0689 0.0644
Trypanosoma cruzi aurora B kinase, putative 0.0071 0.1813 0.1391
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0121 0.3763 0.3681
Trypanosoma brucei polo-like protein kinase 0.0118 0.3641 0.5397
Echinococcus granulosus tyrosine protein kinase Src42A 0.0092 0.2636 0.254
Trichomonas vaginalis AGC family protein kinase 0.0071 0.1813 0.2214
Mycobacterium leprae possibleputative FAD-linked oxidoreductase 0.0171 0.5742 0.5
Schistosoma mansoni serine/threonine protein kinase 0.0055 0.1178 0.1186
Schistosoma mansoni tyrosine kinase 0.0256 0.9135 1
Trypanosoma brucei protein kinase, putative 0.0061 0.1413 0.0514
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0043 0.0689 0.0567
Echinococcus granulosus tyrosine protein kinase Src42A 0.0121 0.3763 0.3681
Entamoeba histolytica protein kinase, putative 0.0071 0.1813 0.4979
Loa Loa (eye worm) TK protein kinase 0.0099 0.292 0.2827
Mycobacterium ulcerans oxidoreductase 0.0171 0.5742 0.5
Loa Loa (eye worm) SRC-1 0.0121 0.3763 0.3681
Mycobacterium ulcerans hypothetical protein 0.0171 0.5742 0.5
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0118 0.3641 0.3558
Loa Loa (eye worm) AUR protein kinase 0.0071 0.1813 0.1706
Trichomonas vaginalis CAMK family protein kinase 0.0118 0.3641 0.8588
Trichomonas vaginalis CAMK family protein kinase 0.006 0.1358 0.0629
Trypanosoma cruzi hypothetical protein, conserved 0.0171 0.5742 1
Giardia lamblia Kinase, NEK 0.0128 0.4046 1
Loa Loa (eye worm) TK/ABL protein kinase 0.0278 1 1
Brugia malayi Sex muscle abnormal protein 5 0.0043 0.0689 0.1131
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0121 0.3763 0.3681
Brugia malayi serine/threonine-protein kinase plk-2 0.0118 0.3641 0.7097
Brugia malayi C1-like domain containing protein 0.0114 0.3502 0.6816
Trichomonas vaginalis CAMK family protein kinase 0.006 0.1358 0.0629
Loa Loa (eye worm) hypothetical protein 0.0098 0.2865 0.2772
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0099 0.292 0.2827
Giardia lamblia Kinase, CMGC GSK 0.0061 0.1413 0.0819
Echinococcus granulosus serine:threonine protein kinase 12 B 0.0071 0.1813 0.1706
Brugia malayi serine/threonine kinase 12 0.0071 0.1813 0.3403
Echinococcus granulosus protein kinase shaggy 0.0061 0.1413 0.1301
Entamoeba histolytica cell division protein kinase 2, putative 0.0055 0.1178 0.3236
Mycobacterium ulcerans FAD-linked oxidoreductase 0.0171 0.5742 0.5
Echinococcus multilocularis serine:threonine protein kinase 12 B 0.0071 0.1813 0.1706
Giardia lamblia Kinase, CMGC GSK 0.0061 0.1413 0.0819
Mycobacterium tuberculosis Probable oxidoreductase 0.0171 0.5742 0.5
Echinococcus multilocularis aurora kinase A 0.0071 0.1813 0.1706
Entamoeba histolytica protein kinase, putative 0.0049 0.0938 0.2577
Echinococcus granulosus growth factor receptor bound protein 2 0.0043 0.0689 0.0567
Loa Loa (eye worm) hypothetical protein 0.0052 0.1024 0.0907
Echinococcus granulosus tyrosine protein kinase Fyn 0.0121 0.3763 0.3681
Mycobacterium ulcerans oxidoreductase GMC-type 0.0171 0.5742 0.5
Trypanosoma brucei Monooxygenase, putative 0.0171 0.5742 1
Trichomonas vaginalis CAMK family protein kinase 0.0118 0.3641 0.8588
Toxoplasma gondii FAD binding domain-containing protein 0.0171 0.5742 1
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0034 0.0328 0.0244
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0061 0.1413 0.0514
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0061 0.1413 0.1446
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0043 0.0689 0.0644
Schistosoma mansoni serine/threonine protein kinase 0.0118 0.3641 0.3914
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0061 0.1413 0.1301
Brugia malayi Tyrosine-protein kinase abl-1 0.0154 0.5078 1
Plasmodium falciparum FAD-dependent monooxygenase, putative 0.0171 0.5742 1
Trichomonas vaginalis AGC family protein kinase 0.0128 0.4046 1
Echinococcus multilocularis tyrosine protein kinase Srms 0.0099 0.292 0.2827
Brugia malayi Variant SH3 domain containing protein 0.0043 0.0689 0.1131
Plasmodium falciparum glycogen synthase kinase 3 0.0061 0.1413 0.0514
Brugia malayi RhoGAP domain containing protein 0.0034 0.0328 0.0402
Mycobacterium ulcerans membrane-associated oxidoreductase 0.0171 0.5742 0.5
Leishmania major hypothetical protein, conserved 0.0171 0.5742 1
Schistosoma mansoni tyrosine kinase 0.005 0.0972 0.0958
Echinococcus granulosus tyrosine kinase 0.0099 0.292 0.2827
Schistosoma mansoni kinase 0.0061 0.1418 0.1452
Plasmodium vivax hypothetical protein, conserved 0.0171 0.5742 1
Entamoeba histolytica SH2-protein kinase domain containing protein 0.0029 0.0129 0.0354
Mycobacterium ulcerans hypothetical protein 0.0171 0.5742 0.5
Schistosoma mansoni dual specificity serine/threonine tyrosine kinase 0.009 0.2566 0.2723
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0121 0.3763 0.3681
Echinococcus granulosus tyrosine protein kinase Fyn 0.0121 0.3763 0.3681
Echinococcus multilocularis cyclin dependent kinase 5 0.0055 0.1178 0.1063
Onchocerca volvulus 0.011 0.3347 0.9164
Trypanosoma cruzi Monooxygenase, putative 0.0171 0.5742 1
Trypanosoma brucei aurora B kinase 0.0071 0.1813 0.1391
Loa Loa (eye worm) TK protein kinase 0.0078 0.2055 0.1951
Trichomonas vaginalis AGC family protein kinase 0.0071 0.1813 0.2214
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0061 0.1413 0.0514
Echinococcus multilocularis growth factor receptor bound protein 2 0.0043 0.0689 0.0567
Echinococcus multilocularis cyclin dependent kinase 1 0.0055 0.1178 0.1063
Trichomonas vaginalis CAMK family protein kinase 0.0118 0.3641 0.8588
Brugia malayi intracellular kinase 0.0061 0.1413 0.2595
Echinococcus granulosus dual specificity serine:threonine tyrosine 0.009 0.2566 0.2469
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0118 0.3641 0.5397
Plasmodium falciparum NIMA related kinase 1 0.0128 0.4046 0.6284
Trypanosoma brucei kynurenine 3-monooxygenase, putative 0.0171 0.5742 1
Echinococcus granulosus cyclin dependent kinase 0.0055 0.1178 0.1063
Trichomonas vaginalis CAMK family protein kinase 0.0118 0.3641 0.8588
Trichomonas vaginalis CAMK family protein kinase 0.009 0.2566 0.4838
Mycobacterium tuberculosis Possible oxidoreductase 0.0171 0.5742 0.5
Mycobacterium tuberculosis Possible oxidoreductase 0.0171 0.5742 0.5
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0121 0.3763 0.3681
Brugia malayi Protein kinase domain containing protein 0.0055 0.1178 0.212
Giardia lamblia Kinase, NEK 0.0128 0.4046 1
Echinococcus multilocularis protein kinase shaggy 0.0061 0.1413 0.1301
Echinococcus multilocularis c src tyrosine kinase 0.005 0.0972 0.0854
Giardia lamblia Kinase, TTK 0.009 0.2566 0.4838
Schistosoma mansoni tyrosine kinase 0.0121 0.3763 0.4049
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0055 0.1178 0.1063
Trichomonas vaginalis CAMK family protein kinase 0.0118 0.3641 0.8588
Echinococcus multilocularis tyrosine protein kinase ABL1 0.0278 1 1
Onchocerca volvulus Serine\/threonine kinase homolog 0.0118 0.3641 1
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0121 0.3763 0.3681
Echinococcus granulosus guanine nucleotide exchange factor VAV2 0.0034 0.0328 0.0201
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.005 0.0972 0.0854
Entamoeba histolytica protein kinase, putative 0.0071 0.1813 0.4979
Loa Loa (eye worm) AUR protein kinase 0.0071 0.1813 0.1706
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0102 0.302 0.2929
Echinococcus multilocularis cyclin dependent kinase 1 0.0055 0.1178 0.1063
Trichomonas vaginalis STE family protein kinase 0.0128 0.4046 1
Mycobacterium ulcerans FAD-dependent oxidoreductase 0.0171 0.5742 0.5
Schistosoma mansoni growth factor receptor-bound protein 0.0043 0.0689 0.0644
Schistosoma mansoni vav2 0.0034 0.0328 0.0244
Toxoplasma gondii aurora kinase 0.0071 0.1813 0.1391
Trichomonas vaginalis AGC family protein kinase 0.0071 0.1813 0.2214
Giardia lamblia Kinase, NEK 0.0128 0.4046 1
Onchocerca volvulus 0.0061 0.1413 0.3656
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0034 0.0328 0.0244
Entamoeba histolytica protein kinase domain containing protein 0.0061 0.1413 0.388
Brugia malayi Variant SH3 domain containing protein 0.0043 0.0689 0.1131
Echinococcus granulosus protein MICAL 3 0.0171 0.5742 0.5687
Trichomonas vaginalis CAMK family protein kinase 0.0118 0.3641 0.8588
Echinococcus granulosus c src tyrosine kinase 0.005 0.0972 0.0854
Entamoeba histolytica protein kinase, putative 0.0049 0.0938 0.2577
Giardia lamblia Aurora kinase 0.0071 0.1813 0.2214
Trichomonas vaginalis CMGC family protein kinase 0.0061 0.1413 0.0819
Loa Loa (eye worm) hypothetical protein 0.0043 0.0689 0.0567
Brugia malayi SRC-1 0.0121 0.3763 0.7343
Loa Loa (eye worm) RhoGAP domain-containing protein 0.0034 0.0328 0.0201
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0121 0.3763 0.3681
Echinococcus multilocularis NCK adaptor protein 0.0043 0.0689 0.0567
Brugia malayi Protein kinase domain containing protein 0.009 0.2566 0.4924
Plasmodium vivax glycogen synthase kinase 3, putative 0.0061 0.1413 0.0514
Echinococcus granulosus tyrosine protein kinase Fyn 0.0121 0.3763 0.3681
Schistosoma mansoni serine/threonine protein kinase 0.0055 0.1178 0.1186
Wolbachia endosymbiont of Brugia malayi 2-polyprenyl-6-methoxyphenol 4-hydroxylase 0.0171 0.5742 0.5
Brugia malayi serine/threonine protein kinase 6 0.0071 0.1813 0.3403
Echinococcus granulosus N chimaerin 0.0034 0.0328 0.0201
Loa Loa (eye worm) hypothetical protein 0.0171 0.5742 0.5687
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0121 0.3763 0.3681
Echinococcus multilocularis dual specificity serine:threonine tyrosine 0.009 0.2566 0.2469
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0061 0.1413 0.0514
Leishmania major hypothetical protein, conserved 0.0171 0.5742 1
Entamoeba histolytica protein kinase, putative 0.0061 0.1413 0.388
Echinococcus granulosus tyrosine protein kinase Src64B 0.0121 0.3763 0.3681
Echinococcus granulosus cyclin dependent kinase 5 0.0055 0.1178 0.1063
Echinococcus granulosus ubiquinone biosynthesis monooxygenase COQ6 0.0171 0.5742 0.5687
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0121 0.3763 0.3681
Entamoeba histolytica protein kinase domain containing protein 0.0071 0.1813 0.4979
Echinococcus granulosus NCK adaptor protein 0.0043 0.0689 0.0567
Mycobacterium ulcerans hypothetical protein 0.0171 0.5742 0.5
Plasmodium vivax serine/threonine protein kinase 6, putative 0.0071 0.1813 0.1391
Echinococcus multilocularis tyrosine protein kinase Blk 0.0099 0.292 0.2827
Echinococcus multilocularis N chimaerin 0.0034 0.0328 0.0201
Echinococcus multilocularis cyclin dependent kinase 0.0055 0.1178 0.1063
Mycobacterium ulcerans oxidoreductase 0.0171 0.5742 0.5
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0118 0.3641 0.3558
Trypanosoma cruzi polo-like protein kinase, putative 0.0118 0.3641 0.5397
Brugia malayi serine/threonine-protein kinase 6 0.0071 0.1813 0.3403
Schistosoma mansoni adapter molecule crk 0.0043 0.0689 0.0644
Echinococcus granulosus cyclin dependent kinase 1 0.0055 0.1178 0.1063
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0121 0.3763 0.3681
Echinococcus multilocularis tyrosine protein kinase Abl 0.0145 0.4746 0.4678
Entamoeba histolytica serine/threonine protein kinase, putative 0.0118 0.3641 1
Entamoeba histolytica protein kinase domain containing protein 0.0061 0.1413 0.388
Echinococcus multilocularis tyrosine protein kinase HCK 0.0078 0.2055 0.1951
Brugia malayi Tyrosine-protein kinase abl-1 0.0145 0.4746 0.933
Schistosoma mansoni tyrosine kinase 0.0029 0.0129 0.0024
Toxoplasma gondii FAD binding domain-containing protein 0.0171 0.5742 1
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0055 0.1178 0.1063
Entamoeba histolytica serine/threonine- protein kinase 6, putative 0.0071 0.1813 0.4979
Echinococcus granulosus tyrosine protein kinase HCK 0.0078 0.2055 0.1951
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0061 0.1413 0.1301
Onchocerca volvulus Dual specificity protein kinase TTK homolog 0.009 0.2566 0.6938
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0043 0.0689 0.0567
Entamoeba histolytica protein kinase, putative 0.0078 0.2055 0.5644
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0092 0.2636 0.254
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0055 0.1178 0.1063
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0055 0.1178 0.1063
Leishmania major protein kinase, putative 0.0071 0.1813 0.1391
Brugia malayi protein-tyrosine kinase 0.0099 0.292 0.5639
Echinococcus granulosus tyrosine protein kinase Lyn 0.0125 0.3917 0.3838
Schistosoma mansoni serine/threonine protein kinase 0.0049 0.0938 0.0921
Brugia malayi Variant SH3 domain containing protein 0.0034 0.0328 0.0402
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0121 0.3763 0.3681
Entamoeba histolytica cell division protein kinase 2, putative 0.0055 0.1178 0.3236
Loa Loa (eye worm) hypothetical protein 0.011 0.3347 0.3261
Mycobacterium tuberculosis Probable oxidoreductase 0.0171 0.5742 0.5
Trypanosoma cruzi polo-like protein kinase, putative 0.0118 0.3641 0.5397
Entamoeba histolytica serine/threonine- protein kinase 6 , putative 0.0071 0.1813 0.4979
Echinococcus granulosus aurora kinase A 0.0071 0.1813 0.1706
Brugia malayi cell division control protein 2 homolog 0.0055 0.1178 0.212
Entamoeba histolytica serine/threonine protein kinase 6, putative 0.0071 0.1813 0.4979
Trichomonas vaginalis CMGC family protein kinase 0.0061 0.1413 0.0819
Echinococcus granulosus calcium:calmodulin dependent protein kinase I 0.0049 0.0938 0.0819
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.005 0.0972 0.0958
Loa Loa (eye worm) hypothetical protein 0.011 0.3347 0.3261
Trichomonas vaginalis CAMK family protein kinase 0.009 0.2566 0.4838
Echinococcus multilocularis protein MICAL 3 0.0171 0.5742 0.5687
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0114 0.3502 0.3417
Loa Loa (eye worm) TTK protein kinase 0.009 0.2566 0.2469
Onchocerca volvulus 0.0098 0.2865 0.7791
Entamoeba histolytica protein kinase , putative 0.0071 0.1813 0.4979
Echinococcus granulosus tyrosine protein kinase Blk 0.0099 0.292 0.2827
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0061 0.1413 0.1301
Schistosoma mansoni tyrosine kinase 0.005 0.0972 0.0958
Echinococcus granulosus serine:threonine protein kinase Chk2 0.0049 0.0938 0.082
Schistosoma mansoni monoxygenase 0.0171 0.5742 0.6241
Echinococcus granulosus tyrosine protein kinase Btk29A 0.005 0.0972 0.0854
Loa Loa (eye worm) hypothetical protein 0.0098 0.2865 0.2772
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0118 0.3641 0.3558
Chlamydia trachomatis monooxygenase 0.0171 0.5742 0.5
Onchocerca volvulus 0.011 0.3347 0.9164
Brugia malayi Phorbol esters/diacylglycerol binding domain 0.0114 0.3502 0.6816
Trichomonas vaginalis CAMK family protein kinase 0.0118 0.3641 0.8588
Schistosoma mansoni serine/threonine protein kinase 0.0071 0.1813 0.1889
Mycobacterium tuberculosis Possible oxidoreductase 0.0171 0.5742 0.5
Loa Loa (eye worm) hypothetical protein 0.0102 0.3038 0.2948
Schistosoma mansoni protein kinase C mu 0.0114 0.3502 0.376
Loa Loa (eye worm) AUR protein kinase 0.0071 0.1813 0.1706
Plasmodium vivax FAD-dependent monooxygenase, putative 0.0171 0.5742 1
Schistosoma mansoni tyrosine kinase 0.0121 0.3763 0.4049
Schistosoma mansoni protein kinase 0.0071 0.1813 0.1889
Toxoplasma gondii NIMA-related protein kinase NIMA1 0.0128 0.4046 0.6284
Trichomonas vaginalis AGC family protein kinase 0.0071 0.1813 0.2214
Plasmodium falciparum serine/threonine protein kinase, putative 0.0071 0.1813 0.1391
Schistosoma mansoni tyrosine kinase 0.0029 0.0129 0.0024
Echinococcus multilocularis calcium:calmodulin dependent protein kinase I 0.0049 0.0938 0.0819
Schistosoma mansoni hypothetical protein 0.0171 0.5742 0.6241
Echinococcus multilocularis ubiquinone biosynthesis monooxygenase COQ6 0.0171 0.5742 0.5687
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0121 0.3763 0.3681
Schistosoma mansoni nck2/grb4 0.0043 0.0689 0.0644
Echinococcus multilocularis guanine nucleotide exchange factor VAV2 0.0034 0.0328 0.0201
Echinococcus multilocularis serine:threonine protein kinase Chk2 0.0049 0.0938 0.082
Giardia lamblia Kinase, PLK 0.0118 0.3641 0.8588
Plasmodium vivax NIMA-related protein kinase (Pfnek-1), putative 0.0128 0.4046 0.6284

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.073 uM Inhibition of Nek2 using 5-FAM-KKLNRTLSVA-COOH as substrate after 1 hr by caliper method ChEMBL. 22404346
IC50 (binding) = 8.41 uM Inhibition of Plk1 using 5-FAMRRRAGALMDASFEEQ- CONH2 as substrate after 75 mins by caliper method ChEMBL. 22404346

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

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

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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