Detailed information for compound 1568090

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 487.822 | Formula: C19H28BrClN6O2
  • H donors: 3 H acceptors: 3 LogP: 3.52 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)CCC[N+](CCNC(=O)c1nc(Cl)c(nc1N)N)(C)C.[Br-]
  • InChi: 1S/C19H27ClN6O2.BrH/c1-26(2,11-4-5-13-6-8-14(28-3)9-7-13)12-10-23-19(27)15-17(21)25-18(22)16(20)24-15;/h6-9H,4-5,10-12H2,1-3H3,(H4-,21,22,23,25,27);1H
  • InChiKey: IUKQOBIFMQLICK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus tyrosine protein kinase Src64B 0.0144 0.0918 0.0889
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0054 0.0094 0.015
Echinococcus granulosus roundabout 2 0.0049 0.0053 0.0022
Echinococcus granulosus contactin 0.0072 0.0257 0.0227
Brugia malayi P38 map kinase family protein 2 0.0134 0.0819 0.1881
Loa Loa (eye worm) hypothetical protein 0.0117 0.0671 0.1586
Onchocerca volvulus 0.0082 0.0352 0.0952
Echinococcus granulosus semaphorin 5B 0.0082 0.0352 0.0321
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0144 0.0918 0.204
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0047 0.0031 0.0069
Loa Loa (eye worm) TK/FER protein kinase 0.0063 0.0182 0.0427
Echinococcus granulosus epidermal growth factor receptor 0.0482 0.3982 0.3963
Loa Loa (eye worm) TK/FER protein kinase 0.0063 0.0182 0.0427
Echinococcus granulosus mitogen activated protein kinase 14 0.0134 0.0819 0.079
Onchocerca volvulus Tyrosine kinase homolog 0.0352 0.2801 1
Echinococcus granulosus tyrosine protein kinase shark 0.0063 0.0182 0.0151
Echinococcus multilocularis MAP kinase activated protein kinase 2 0.0365 0.2925 0.6659
Loa Loa (eye worm) TK/FER protein kinase 0.0063 0.0182 0.0427
Echinococcus granulosus MAP kinase activated protein kinase 2 0.0365 0.2925 0.2902
Onchocerca volvulus 0.0063 0.0182 0.0326
Loa Loa (eye worm) hypothetical protein 0.0056 0.0114 0.0264
Brugia malayi hypothetical protein 0.0082 0.0352 0.0765
Brugia malayi map kinase activated protein kinase protein 2 0.0365 0.2925 0.691
Schistosoma mansoni serine/threonine protein kinase 0.0101 0.0528 0.1185
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0047 0.0031 0.0069
Echinococcus granulosus defective proboscis extension response 0.01 0.0514 0.0484
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0054 0.0094 0.0795
Entamoeba histolytica protein kinase domain containing protein 0.0073 0.0265 0.4718
Echinococcus granulosus tyrosine protein kinase Src42A 0.0087 0.0392 0.0362
Schistosoma mansoni tyrosine kinase 0.0374 0.3006 0.7105
Echinococcus multilocularis contactin neuroglian septate junction protein 0.0049 0.0053 0.0049
Brugia malayi serine/threonine kinase 12 0.0062 0.0172 0.0335
Loa Loa (eye worm) hypothetical protein 0.0063 0.0182 0.0427
Echinococcus granulosus tyrosine protein kinase Blk 0.0123 0.0725 0.0696
Entamoeba histolytica protein kinase , putative 0.0062 0.0172 0.2831
Loa Loa (eye worm) hypothetical protein 0.0117 0.0671 0.1586
Loa Loa (eye worm) TK/FER protein kinase 0.0063 0.0182 0.0427
Entamoeba histolytica serine/threonine- protein kinase 6, putative 0.0062 0.0172 0.2831
Trichomonas vaginalis AGC family protein kinase 0.0062 0.0172 0.2831
Schistosoma mansoni tyrosine kinase 0.0482 0.3982 0.9435
Echinococcus granulosus tyrosine protein kinase Src42A 0.0144 0.0918 0.0889
Loa Loa (eye worm) TK/FER protein kinase 0.0063 0.0182 0.0427
Echinococcus multilocularis neuroglian 0.0116 0.0656 0.1439
Echinococcus granulosus tyrosine protein kinase Fyn 0.0144 0.0918 0.0889
Echinococcus multilocularis mitogen activated protein kinase 11 0.0134 0.0819 0.1813
Echinococcus multilocularis growth factor receptor bound protein 2 0.0048 0.0042 0.0023
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0087 0.0392 0.0831
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0053 0.0051
Entamoeba histolytica protein kinase, putative 0.0062 0.0172 0.2831
Entamoeba histolytica serine/threonine protein kinase 6, putative 0.0062 0.0172 0.2831
Brugia malayi Tyrosine-protein kinase abl-1 0.0085 0.0375 0.082
Echinococcus multilocularis hemicentin 1 0.0054 0.01 0.0158
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0054 0.0098 0.0227
Onchocerca volvulus 0.0063 0.0182 0.0326
Schistosoma mansoni growth factor receptor-bound protein 0.0048 0.0042 0.0024
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0144 0.0918 0.204
Echinococcus multilocularis ephrin type A receptor 4 A 0.0106 0.0568 0.1234
Echinococcus multilocularis tyrosine protein kinase ABL1 0.0063 0.0182 0.0347
Schistosoma mansoni hypothetical protein 0.0102 0.0528 0.1186
Trichomonas vaginalis AGC family protein kinase 0.0062 0.0172 0.2831
Schistosoma mansoni serine/threonine protein kinase 0.0365 0.2925 0.691
Leishmania major mitogen-activated protein kinase 3, putative,map kinase 3, putative 0.0134 0.0819 1
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0123 0.0725 0.1597
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0048 0.0042 0.0093
Plasmodium falciparum protein kinase 5 0.0047 0.0031 0.1828
Brugia malayi serine/threonine-protein kinase plk-2 0.0101 0.0528 0.1185
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0049 0.0053 0.0049
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0144 0.0918 0.204
Loa Loa (eye worm) CAMK/PIM protein kinase 0.0168 0.1131 0.2676
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0053 0.0051
Echinococcus granulosus roundabout 2 0.0049 0.0053 0.0022
Schistosoma mansoni plexin 0.0184 0.1274 0.2969
Brugia malayi Sema domain containing protein 0.0082 0.0352 0.0765
Echinococcus multilocularis semaphorin 5B 0.0082 0.0352 0.0737
Echinococcus multilocularis tyrosine protein kinase shark 0.0063 0.0182 0.0347
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0049 0.0053 0.0051
Schistosoma mansoni hypothetical protein 0.0082 0.0352 0.0765
Echinococcus granulosus epidermal growth factor receptor 0.0411 0.3339 0.3318
Echinococcus multilocularis 0.0217 0.1574 0.3551
Echinococcus granulosus protein kinase shaggy 0.0054 0.0094 0.0063
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0101 0.0528 0.6298
Onchocerca volvulus 0.0184 0.1274 0.436
Schistosoma mansoni tyrosine kinase 0.0411 0.3339 0.79
Echinococcus multilocularis aurora kinase A 0.0062 0.0172 0.0323
Loa Loa (eye worm) AUR protein kinase 0.0062 0.0172 0.0402
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0116 0.0661 0.0631
Loa Loa (eye worm) sema domain-containing protein 0.0082 0.0352 0.0829
Schistosoma mansoni ephrin receptor 0.0093 0.0447 0.0992
Schistosoma mansoni tyrosine kinase 0.0144 0.0918 0.2116
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0101 0.0528 0.0498
Schistosoma mansoni tyrosine kinase 0.0085 0.0375 0.082
Loa Loa (eye worm) TK/INSR protein kinase 0.0508 0.4218 1
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0101 0.0528 0.1142
Onchocerca volvulus Basement membrane proteoglycan homolog 0.0054 0.01 0.0022
Onchocerca volvulus Serine\/threonine protein kinase homolog 0.0168 0.1131 0.3829
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0144 0.0918 0.204
Schistosoma mansoni kinase 0.0054 0.0095 0.0152
Echinococcus granulosus tyrosine kinase 0.0063 0.0182 0.0151
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.0528 1
Loa Loa (eye worm) hypothetical protein 0.0213 0.1543 0.3654
Schistosoma mansoni vesicular amine transporter 0.01 0.0514 0.1152
Brugia malayi SH2 domain containing protein 0.0063 0.0182 0.036
Brugia malayi Protein kinase domain containing protein 0.0063 0.0182 0.036
Echinococcus multilocularis tyrosine protein kinase Abl 0.0085 0.0375 0.079
Leishmania major protein kinase, putative 0.0062 0.0172 0.1783
Echinococcus multilocularis Immunoglobulin 0.01 0.0514 0.111
Onchocerca volvulus 0.0277 0.2121 0.7487
Echinococcus granulosus tyrosine protein kinase transmembrane receptor 0.0052 0.0081 0.005
Brugia malayi Serine/threonine-protein kinase Pim-3 0.0168 0.1131 0.2625
Echinococcus multilocularis protein kinase shaggy 0.0054 0.0094 0.0144
Echinococcus granulosus NCK adaptor protein 0.0048 0.0042 0.001
Loa Loa (eye worm) CAMK/PIM protein kinase 0.0168 0.1131 0.2676
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0101 0.0528 0.1246
Schistosoma mansoni serine/threonine protein kinase 0.0062 0.0172 0.0335
Echinococcus multilocularis insulin receptor 0.0508 0.4218 0.9638
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0054 0.0094 0.4458
Schistosoma mansoni tyrosine kinase 0.0508 0.4218 1
Brugia malayi serine/threonine-protein kinase 6 0.0062 0.0172 0.0335
Echinococcus granulosus neuroglian 0.0116 0.0656 0.0627
Loa Loa (eye worm) TK/ROR protein kinase 0.0052 0.0081 0.0187
Entamoeba histolytica protein kinase domain containing protein 0.0054 0.0094 0.1262
Echinococcus granulosus aurora kinase A 0.0062 0.0172 0.0141
Echinococcus multilocularis tyrosine protein kinase Fps85D 0.0063 0.0182 0.0347
Schistosoma mansoni cell adhesion molecule 0.0049 0.0053 0.0051
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0525 0.4376 0.4358
Loa Loa (eye worm) TK/ABL protein kinase 0.0063 0.0182 0.0427
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0221 0.161 0.1583
Brugia malayi Protein kinase domain containing protein 0.0168 0.1131 0.2626
Giardia lamblia Kinase, PLK 0.0101 0.0528 1
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.0528 1
Loa Loa (eye worm) hypothetical protein 0.047 0.3878 0.9192
Echinococcus granulosus roundabout 2 0.0149 0.0961 0.0932
Echinococcus granulosus tyrosine protein kinase HCK 0.0096 0.0481 0.0451
Echinococcus multilocularis epidermal growth factor receptor 0.0411 0.3339 0.7614
Loa Loa (eye worm) hypothetical protein 0.01 0.0516 0.1217
Toxoplasma gondii aurora kinase 0.0062 0.0172 1
Schistosoma mansoni protein kinase 0.0168 0.1131 0.2626
Entamoeba histolytica serine/threonine- protein kinase 6 , putative 0.0062 0.0172 0.2831
Echinococcus granulosus ephrin type A receptor 4 A 0.0106 0.0568 0.0538
Plasmodium vivax glycogen synthase kinase 3, putative 0.0054 0.0094 0.5471
Echinococcus granulosus proto oncogene serine:threonine protein kinase 0.0168 0.1131 0.1103
Loa Loa (eye worm) SRC-1 0.0144 0.0918 0.2171
Loa Loa (eye worm) hypothetical protein 0.0082 0.0352 0.0829
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.0134 0.0819 1
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0411 0.3339 0.3318
Loa Loa (eye worm) hypothetical protein 0.0082 0.0352 0.0829
Giardia lamblia Kinase, CMGC GSK 0.0054 0.0094 0.1262
Schistosoma mansoni tyrosine kinase 0.0063 0.0182 0.036
Trypanosoma brucei polo-like protein kinase 0.0101 0.0528 0.6298
Onchocerca volvulus 0.0063 0.0182 0.0326
Loa Loa (eye worm) hypothetical protein 0.0117 0.0671 0.1586
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0054 0.0094 0.0063
Brugia malayi Protein kinase domain containing protein 0.0063 0.0182 0.036
Loa Loa (eye worm) TK/FER protein kinase 0.0063 0.0182 0.0427
Schistosoma mansoni cell adhesion molecule 0.0049 0.0053 0.0051
Schistosoma mansoni Neurotrimin precursor (hNT) 0.01 0.0514 0.1152
Onchocerca volvulus 0.0056 0.011 0.006
Loa Loa (eye worm) camk/mapkapk/mnk protein kinase 0.0429 0.3499 0.8294
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0048 0.0042 0.0024
Onchocerca volvulus 0.0063 0.0182 0.0326
Loa Loa (eye worm) TK/EGFR protein kinase 0.0482 0.3982 0.9439
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0049 0.0053 0.012
Echinococcus multilocularis neuroglian 0.0049 0.0053 0.0049
Loa Loa (eye worm) hypothetical protein 0.0082 0.0352 0.0829
Entamoeba histolytica protein kinase, putative 0.0062 0.0172 0.2831
Schistosoma mansoni plexin 0.0102 0.0528 0.1186
Echinococcus multilocularis tyrosine protein kinase HCK 0.0096 0.0481 0.1036
Loa Loa (eye worm) TK/EPH protein kinase 0.0108 0.0586 0.1384
Echinococcus multilocularis epidermal growth factor receptor 0.0482 0.3982 0.9093
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0054 0.0094 0.0217
Schistosoma mansoni tyrosine kinase 0.0374 0.3006 0.7105
Onchocerca volvulus 0.0063 0.0182 0.0326
Loa Loa (eye worm) TK/FER protein kinase 0.0063 0.0182 0.0427
Brugia malayi Immunoglobulin I-set domain containing protein 0.043 0.3509 0.8306
Entamoeba histolytica tyrosin kinase, putative 0.0073 0.0265 0.4718
Onchocerca volvulus 0.0056 0.0114 0.0072
Plasmodium vivax protein kinase Crk2 0.0047 0.0031 0.1828
Schistosoma mansoni serine/threonine protein kinase 0.0058 0.0131 0.0237
Trypanosoma brucei mitogen-activated protein kinase 3, putative 0.0134 0.0819 1
Brugia malayi Protein kinase domain containing protein 0.025 0.1876 0.4405
Echinococcus multilocularis c src tyrosine kinase 0.0085 0.0375 0.079
Brugia malayi Plexin repeat family protein 0.0184 0.1274 0.2969
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0048 0.0042 0.0093
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0049 0.0053 0.0022
Echinococcus granulosus STE20 serine:threonine protein kinase 0.0475 0.3923 0.3904
Onchocerca volvulus Serine\/threonine kinase homolog 0.0101 0.0528 0.1601
Loa Loa (eye worm) sema domain-containing protein 0.0082 0.0352 0.0829
Echinococcus granulosus neuroglian 0.0049 0.0053 0.0022
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.0134 0.0819 1
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.0528 1
Echinococcus multilocularis proto oncogene serine:threonine protein kinase 0.0168 0.1131 0.253
Schistosoma mansoni nephrin 0.0133 0.0814 0.1869
Loa Loa (eye worm) hypothetical protein 0.0082 0.0352 0.0829
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0144 0.0918 0.204
Echinococcus multilocularis roundabout 2 0.0049 0.0053 0.0049
Plasmodium vivax serine/threonine protein kinase 6, putative 0.0062 0.0172 1
Brugia malayi ephrin receptor 1 precursor 0.0063 0.0178 0.035
Brugia malayi Protein kinase domain containing protein 0.0429 0.3499 0.8282
Loa Loa (eye worm) hypothetical protein 0.0184 0.1274 0.3017
Brugia malayi hypothetical protein 0.0082 0.0352 0.0765
Echinococcus multilocularis roundabout 2 0.0149 0.0961 0.214
Echinococcus granulosus Immunoglobulin 0.01 0.0514 0.0484
Trypanosoma cruzi aurora B kinase, putative 0.0062 0.0172 0.1783
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.0528 1
Trichomonas vaginalis CMGC family protein kinase 0.0054 0.0094 0.1262
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0525 0.4376 1
Loa Loa (eye worm) hypothetical protein 0.01 0.0514 0.1212
Echinococcus granulosus hemicentin 1 0.0054 0.01 0.0069
Schistosoma mansoni growth factor receptor-bound protein 0.0048 0.0042 0.0024
Loa Loa (eye worm) hypothetical protein 0.0132 0.0804 0.19
Echinococcus granulosus tyrosine protein kinase Lyn 0.0149 0.0963 0.0934
Plasmodium falciparum serine/threonine protein kinase, putative 0.0062 0.0172 1
Trichomonas vaginalis CAMK family protein kinase 0.0053 0.0083 0.1048
Brugia malayi Furin-like cysteine rich region family protein 0.0482 0.3982 0.9435
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.0528 1
Loa Loa (eye worm) hypothetical protein 0.0049 0.0053 0.012
Schistosoma mansoni nck2/grb4 0.0048 0.0042 0.0024
Echinococcus multilocularis tyrosine protein kinase transmembrane receptor 0.0052 0.0081 0.0115
Loa Loa (eye worm) AUR protein kinase 0.0062 0.0172 0.0402
Loa Loa (eye worm) hypothetical protein 0.0048 0.0042 0.0093
Loa Loa (eye worm) hypothetical protein 0.0082 0.0352 0.0829
Trichomonas vaginalis CMGC family protein kinase 0.0054 0.0094 0.1262
Brugia malayi Protein kinase domain containing protein 0.0063 0.0182 0.036
Brugia malayi hypothetical protein 0.0063 0.0182 0.036
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0123 0.0725 0.0696
Echinococcus granulosus tyrosine protein kinase ABL1 0.0063 0.0182 0.0151
Echinococcus multilocularis basement membrane specific heparan sulfate 0.01 0.0514 0.111
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0054 0.0094 0.0144
Schistosoma mansoni neuroglian 0.0049 0.0053 0.0051
Loa Loa (eye worm) TK/FER protein kinase 0.0063 0.0182 0.0427
Brugia malayi Variant SH3 domain containing protein 0.0048 0.0042 0.0024
Schistosoma mansoni hypothetical protein 0.0082 0.0352 0.0765
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0144 0.0918 0.0889
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0053 0.0051
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0144 0.0918 0.204
Brugia malayi Protein kinase domain containing protein 0.0063 0.0182 0.036
Schistosoma mansoni tyrosine kinase 0.0069 0.0228 0.0471
Echinococcus granulosus insulin receptor 0.0508 0.4218 0.42
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0054 0.0094 0.0217
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0085 0.0375 0.082
Echinococcus multilocularis tyrosine protein kinase Srms 0.0123 0.0725 0.1597
Schistosoma mansoni ephrin receptor 0.0054 0.0096 0.0154
Echinococcus multilocularis NCK adaptor protein 0.0048 0.0042 0.0023
Brugia malayi Protein kinase domain containing protein 0.0508 0.4218 1
Trypanosoma cruzi polo-like protein kinase, putative 0.0101 0.0528 0.6298
Brugia malayi Protein kinase domain containing protein 0.0168 0.1131 0.2625
Trypanosoma cruzi polo-like protein kinase, putative 0.0101 0.0528 0.6298
Loa Loa (eye worm) TK/KIN16 protein kinase 0.043 0.3509 0.8317
Echinococcus granulosus semaphorin 1A 0.0082 0.0352 0.0321
Entamoeba histolytica SH2-protein kinase domain containing protein 0.0063 0.0182 0.3042
Loa Loa (eye worm) hypothetical protein 0.01 0.0514 0.1212
Echinococcus multilocularis Immunoglobulin 0.01 0.0514 0.111
Entamoeba histolytica protein kinase, putative 0.0096 0.0481 0.9072
Brugia malayi Fibronectin type III domain containing protein 0.0117 0.0671 0.1528
Echinococcus granulosus c src tyrosine kinase 0.0085 0.0375 0.0344
Echinococcus multilocularis roundabout 2 0.0049 0.0053 0.0049
Echinococcus granulosus tyrosine protein kinase Fyn 0.0144 0.0918 0.0889
Schistosoma mansoni nephrin 0.0049 0.0053 0.0051
Echinococcus multilocularis plexin a4 0.022 0.1601 0.3614
Schistosoma mansoni tyrosine kinase 0.0374 0.3006 0.7105
Brugia malayi protein-tyrosine kinase 0.0123 0.0725 0.1657
Schistosoma mansoni tyrosine kinase 0.0411 0.3339 0.79
Echinococcus multilocularis mitogen activated protein kinase 14 0.0134 0.0819 0.1813
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.01 0.0514 0.1152
Echinococcus multilocularis tyrosine kinase 0.0063 0.0182 0.0347
Entamoeba histolytica protein kinase domain containing protein 0.0054 0.0094 0.1262
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0144 0.0918 0.204
Loa Loa (eye worm) plexin A 0.022 0.1601 0.3793
Schistosoma mansoni titin 0.0054 0.01 0.0164
Brugia malayi Protein kinase domain containing protein 0.0063 0.0182 0.036
Schistosoma mansoni adapter molecule crk 0.0048 0.0042 0.0024
Entamoeba histolytica protein kinase domain containing protein 0.0062 0.0172 0.2831
Echinococcus granulosus tyrosine protein kinase Fyn 0.0144 0.0918 0.0889
Echinococcus granulosus tyrosine kinase 0.0123 0.0725 0.0696
Schistosoma mansoni cell adhesion molecule 0.0133 0.0818 0.1879
Loa Loa (eye worm) TK/FER protein kinase 0.0063 0.0182 0.0427
Trypanosoma brucei protein kinase, putative 0.0054 0.0094 0.0795
Loa Loa (eye worm) hypothetical protein 0.0116 0.0661 0.1561
Brugia malayi Sex muscle abnormal protein 5 0.0048 0.0042 0.0024
Giardia lamblia Kinase, CMGC GSK 0.0054 0.0094 0.1262
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0144 0.0918 0.204
Plasmodium falciparum glycogen synthase kinase 3 0.0054 0.0094 0.5471
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.0528 1
Loa Loa (eye worm) TK protein kinase 0.0052 0.0081 0.0187
Schistosoma mansoni protein kinase 0.0062 0.0172 0.0335
Echinococcus granulosus serine:threonine protein kinase 12 B 0.0062 0.0172 0.0141
Brugia malayi intracellular kinase 0.0054 0.0094 0.015
Loa Loa (eye worm) TK/FER protein kinase 0.0063 0.0182 0.0427
Loa Loa (eye worm) hypothetical protein 0.0102 0.0528 0.1247
Schistosoma mansoni tyrosine kinase 0.0085 0.0375 0.082
Entamoeba histolytica protein kinase, putative 0.0054 0.0094 0.1262
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0049 0.0053 0.0049
Brugia malayi SRC-1 0.0144 0.0918 0.2116
Loa Loa (eye worm) AUR protein kinase 0.0062 0.0172 0.0402
Schistosoma mansoni serine/threonine protein kinase 0.0168 0.1131 0.2625
Loa Loa (eye worm) hypothetical protein 0.0154 0.1008 0.2385
Echinococcus multilocularis serine:threonine protein kinase 12 B 0.0062 0.0172 0.0323
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0144 0.0918 0.0889
Schistosoma mansoni tyrosine kinase 0.0508 0.4218 1
Trichomonas vaginalis AGC family protein kinase 0.0062 0.0172 0.2831
Schistosoma mansoni tyrosine kinase 0.0144 0.0918 0.2116
Schistosoma mansoni semaphorin 5-related 0.0082 0.0352 0.0765
Loa Loa (eye worm) STE/STE20/SLK protein kinase 0.0168 0.1131 0.2677
Brugia malayi Variant SH3 domain containing protein 0.0048 0.0042 0.0024
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0144 0.0918 0.204
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0054 0.0094 0.0795
Brugia malayi Sema domain containing protein 0.0082 0.0352 0.0765
Echinococcus multilocularis mitogen activated protein kinase 14 0.0134 0.0819 0.1813
Brugia malayi Immunoglobulin I-set domain containing protein 0.0052 0.0081 0.0119
Loa Loa (eye worm) hypothetical protein 0.0082 0.0352 0.0829
Entamoeba histolytica serine/threonine protein kinase, putative 0.0101 0.0528 1
Brugia malayi serine/threonine protein kinase 6 0.0062 0.0172 0.0335
Echinococcus granulosus twitchin 0.0121 0.0702 0.0673
Schistosoma mansoni hypothetical protein 0.0056 0.011 0.0188
Giardia lamblia Aurora kinase 0.0062 0.0172 0.2831
Echinococcus granulosus tyrosine protein kinase Fps85D 0.0063 0.0182 0.0151
Echinococcus multilocularis mitogen activated protein kinase 11 0.0134 0.0819 0.1813
Loa Loa (eye worm) TK protein kinase 0.0123 0.0725 0.1715
Brugia malayi plexin A 0.022 0.1601 0.375
Echinococcus granulosus growth factor receptor bound protein 2 0.0048 0.0042 0.001
Trypanosoma brucei aurora B kinase 0.0062 0.0172 0.1783
Loa Loa (eye worm) camk/mapkapk/mapkapk protein kinase 0.0365 0.2925 0.6931
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0049 0.0053 0.0049
Echinococcus granulosus tyrosine protein kinase Srms 0.0063 0.0182 0.0151
Echinococcus multilocularis STE20 serine:threonine protein kinase 0.0475 0.3923 0.8958
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.0528 1
Echinococcus granulosus plexin a4 0.022 0.1601 0.1575
Brugia malayi SH2 domain containing protein 0.0063 0.0182 0.036
Echinococcus multilocularis hypothetical protein 0.0082 0.0352 0.0737
Schistosoma mansoni tyrosine kinase 0.0199 0.1417 0.331
Onchocerca volvulus 0.0063 0.0182 0.0326
Echinococcus multilocularis tyrosine protein kinase Blk 0.0123 0.0725 0.1597
Brugia malayi Immunoglobulin I-set domain containing protein 0.0117 0.0671 0.1528
Trichomonas vaginalis AGC family protein kinase 0.0062 0.0172 0.2831
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0221 0.161 0.3633
Loa Loa (eye worm) CMGC/MAPK/P38 protein kinase 0.0134 0.0819 0.1937
Loa Loa (eye worm) TK protein kinase 0.0096 0.0481 0.1136
Echinococcus granulosus mitogen activated protein kinase 11 0.0134 0.0819 0.079
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0047 0.0031 0.0069
Trichomonas vaginalis CAMK family protein kinase 0.0053 0.0083 0.1048
Brugia malayi hypothetical protein 0.0117 0.0671 0.1528

Activities

Activity type Activity value Assay description Source Reference
permeability (ADMET) = 0.93 ucm/s Permeability from apical to basal side of human Caco2 cells ChEMBL. 22197144
permeability (ADMET) = 1.67 ucm/s Permeability from basal to apical side of human Caco2 cells ChEMBL. 22197144

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

No literature references available for this target.

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