Detailed information for compound 1525323

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 1219.71 | Formula: C76H114O12
  • H donors: 0 H acceptors: 5 LogP: 16.38 Rotable bonds: 17
    Rule of 5 violations (Lipinski): 2
  • SMILES: CO[C@H]1CC[C@@]2([C@@H](C1(C)C)CC[C@@]1([C@@H]2CC[C@@H]2C(=CC[C@H]3[C@@]2(C)CC[C@H](C3(C)C)OC(=O)CCC(=O)OCc2occ(c(=O)c2)OC(=O)CCC(=O)O[C@@H]2CC[C@@]3([C@@H](C2(C)C)CC=C2[C@H]3CC[C@H]3[C@@](C2)(C)CC[C@H]2[C@@]3(C)CC[C@@H](C2(C)C)OC)C)C1)C)C
  • InChi: 1S/C76H114O12/c1-67(2)55-29-35-71(9)42-46-17-21-53-69(5,6)61(33-37-73(53,11)49(46)19-23-57(71)75(55,13)39-31-59(67)82-15)87-65(80)26-25-63(78)85-44-48-41-51(77)52(45-84-48)86-64(79)27-28-66(81)88-62-34-38-74(12)50-20-24-58-72(10,43-47(50)18-22-54(74)70(62,7)8)36-30-56-68(3,4)60(83-16)32-40-76(56,58)14/h17-18,41,45,49-50,53-62H,19-40,42-44H2,1-16H3/t49-,50-,53-,54-,55-,56-,57+,58+,59+,60+,61-,62-,71+,72+,73+,74+,75-,76-/m1/s1
  • InChiKey: JONVAGJCSBYEII-NBUIORFNSA-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
Onchocerca volvulus 0.0082 0.0168 0.0245
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0077 0.0144 0.0152
Loa Loa (eye worm) hypothetical protein 0.024 0.108 0.1151
Echinococcus multilocularis roundabout 2 0.0077 0.0144 0.0152
Trypanosoma cruzi UDP-galactopyranose mutase 0.0105 0.0301 0.0595
Brugia malayi Peroxidasin 0.0075 0.0132 0.0141
Schistosoma mansoni src-type protein tyrosine kinase-related 0.0053 0.0001 0.0001
Trypanosoma cruzi sedoheptulose-1,7-bisphosphatase, putative 0.0345 0.1687 0.334
Echinococcus multilocularis tyrosine protein kinase shark 0.0082 0.0168 0.0178
Brugia malayi Furin-like cysteine rich region family protein 0.1677 0.9377 1
Loa Loa (eye worm) hypothetical protein 0.0156 0.0595 0.0634
Brugia malayi Protein kinase domain containing protein 0.0311 0.1494 0.1593
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.0075 0.0132 0.0141
Brugia malayi Fibronectin type III domain containing protein 0.0158 0.0607 0.0647
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Plasmodium falciparum protein kinase, putative 0.006 0.0044 0.0288
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Brugia malayi Receptor family ligand binding region containing protein 0.0053 0.0001 0.0001
Echinococcus multilocularis phosphatidylinositol 3 kinase regulatory subunit 0.011 0.0329 0.035
Entamoeba histolytica SH2-protein kinase domain containing protein 0.0082 0.0168 0.0716
Brugia malayi hypothetical protein 0.0158 0.0607 0.0647
Giardia lamblia Kinase, CMGC CDK 0.0266 0.1231 0.8239
Brugia malayi Sugar transporter family protein 0.0102 0.0285 0.0304
Echinococcus granulosus General substrate transporter 0.0088 0.0202 0.0201
Loa Loa (eye worm) hypothetical protein 0.0082 0.0168 0.0178
Loa Loa (eye worm) TK/FER protein kinase 0.0082 0.0168 0.0178
Entamoeba histolytica cell division protein kinase 2, putative 0.0266 0.1231 0.5269
Trichomonas vaginalis CMGC family protein kinase 0.0266 0.1231 0.8239
Brugia malayi SH2 domain containing protein 0.036 0.1774 0.1892
Entamoeba histolytica hypothetical protein 0.0457 0.2335 1
Schistosoma mansoni tyrosine kinase 0.0128 0.0436 0.0465
Brugia malayi SH2 domain containing protein 0.0082 0.0168 0.0179
Brugia malayi Protein kinase domain containing protein 0.0295 0.1399 0.1492
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0085 0.0187 0.0198
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.1382 0.7676 1
Echinococcus granulosus tyrosine protein kinase Src42A 0.0117 0.0372 0.0371
Schistosoma mansoni cyclin-dependent kinase 5 activator 0.1296 0.7179 0.7656
Echinococcus granulosus tyrosine protein kinase Src42A 0.0188 0.0782 0.0782
Plasmodium vivax protein kinase Crk2 0.0266 0.1231 0.8239
Schistosoma mansoni cell adhesion molecule 0.0075 0.0132 0.0141
Schistosoma mansoni protein kinase 0.006 0.0044 0.0047
Brugia malayi Prion-like- 0.0075 0.0132 0.0141
Schistosoma mansoni tyrosine kinase 0.0563 0.2948 0.3144
Brugia malayi Protein kinase domain containing protein 0.0082 0.0168 0.0179
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Echinococcus granulosus epidermal growth factor receptor 0.0973 0.5315 0.5314
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0188 0.0782 0.0833
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Schistosoma mansoni tyrosine kinase 0.0082 0.0168 0.0179
Brugia malayi Immunoglobulin I-set domain containing protein 0.0182 0.0744 0.0794
Brugia malayi SH2 domain containing protein 0.0082 0.0168 0.0179
Onchocerca volvulus Tyrosine kinase homolog 0.1236 0.6829 1
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Echinococcus multilocularis fructose 1,6 bisphosphatase 1 0.0927 0.5048 0.5383
Brugia malayi Adenylate and Guanylate cyclase catalytic domain containing protein 0.0053 0.0001 0.0001
Brugia malayi protein-tyrosine kinase 0.017 0.0676 0.0721
Toxoplasma gondii cell-cycle-associated protein kinase CLK, putative 0.0311 0.1494 0.2958
Loa Loa (eye worm) hypothetical protein 0.0158 0.0607 0.0646
Loa Loa (eye worm) hypothetical protein 0.0621 0.3278 0.3496
Loa Loa (eye worm) SRC-1 0.0188 0.0782 0.0833
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0105 0.0301 0.0321
Trypanosoma brucei cdc2-related kinase 1 0.0266 0.1231 0.2437
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Plasmodium falciparum hexose transporter 0.0102 0.0285 0.19
Echinococcus granulosus basic fibroblast growth factor receptor 1 A 0.015 0.0563 0.0562
Trypanosoma cruzi kinetoplastid kinetochore protein 10, putative 0.0311 0.1494 0.2958
Echinococcus granulosus contactin 0.0086 0.0193 0.0192
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0188 0.0782 0.0833
Echinococcus multilocularis dual specificity protein kinase clk2 0.0311 0.1494 0.1593
Schistosoma mansoni tyrosine protein kinase fes (fps) (ptk group IV) 0.0053 0.0001 0.0001
Echinococcus granulosus neuroglian 0.0187 0.0776 0.0776
Trypanosoma cruzi kinetoplastid kinetochore protein 10, putative 0.0311 0.1494 0.2958
Echinococcus granulosus tyrosine kinase 0.017 0.0676 0.0675
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.006 0.0044 0.0085
Toxoplasma gondii calcium dependent protein kinase CDPK8 0.006 0.0044 0.0085
Schistosoma mansoni tyrosine kinase 0.1677 0.9377 1
Leishmania major protein kinase, putative 0.0311 0.1494 0.2958
Echinococcus multilocularis 0.0304 0.1451 0.1547
Echinococcus multilocularis tyrosine protein kinase Fyn 0.017 0.0676 0.072
Loa Loa (eye worm) TK/KIN16 protein kinase 0.1396 0.7752 0.8267
Loa Loa (eye worm) hypothetical protein 0.1296 0.7179 0.7656
Echinococcus multilocularis peroxidasin 0.0075 0.0132 0.014
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0102 0.0284 0.1893
Echinococcus multilocularis roundabout 2 0.0233 0.1042 0.1111
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.1487 0.8281 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0102 0.0284 0.0302
Echinococcus granulosus tyrosine protein kinase Lyn 0.0196 0.0825 0.0825
Loa Loa (eye worm) TK/ROR protein kinase 0.0084 0.0182 0.0193
Schistosoma mansoni tyrosine kinase 0.01 0.0274 0.0292
Onchocerca volvulus 0.0054 0.0008 0.001
Plasmodium falciparum lysine-specific histone demethylase 1, putative 0.0105 0.0301 0.201
Echinococcus granulosus tyrosine protein kinase Blk 0.017 0.0676 0.0675
Schistosoma mansoni roundabout 0.0075 0.0132 0.0141
Echinococcus granulosus cyclin dependent kinase 0.0266 0.1231 0.123
Toxoplasma gondii fructose-bisphospatase II 0.0927 0.5048 1
Echinococcus granulosus tyrosine protein kinase HCK 0.0141 0.0509 0.0508
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0188 0.0782 0.0833
Loa Loa (eye worm) hypothetical protein 0.0231 0.1031 0.1098
Giardia lamblia Kinase, CMGC CDK 0.0266 0.1231 0.8239
Echinococcus multilocularis basic fibroblast growth factor receptor 1 A 0.015 0.0563 0.06
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0156 0.0595 0.0635
Brugia malayi proto-oncogene tyrosine-protein kinase FER 0.0053 0.0001 0.0001
Schistosoma mansoni cell adhesion molecule 0.0077 0.0144 0.0153
Schistosoma mansoni tyrosine-protein kinase fps85d 0.0053 0.0001 0.0001
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0077 0.0144 0.0152
Loa Loa (eye worm) hypothetical protein 0.0075 0.0132 0.014
Onchocerca volvulus 0.0105 0.0301 0.044
Brugia malayi SRC-1 0.0188 0.0782 0.0834
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0266 0.1231 0.1312
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0102 0.0284 0.056
Trypanosoma cruzi cdc2-related kinase 1 0.0266 0.1231 0.2437
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0188 0.0782 0.0833
Echinococcus granulosus Immunoglobulin 0.0156 0.0595 0.0594
Echinococcus multilocularis Immunoglobulin 0.0156 0.0595 0.0634
Brugia malayi SWIRM domain containing protein 0.0105 0.0301 0.0321
Echinococcus granulosus ephrin type A receptor 4 A 0.0119 0.0386 0.0385
Trypanosoma brucei CMGC/DYRK protein kinase, putative 0.0457 0.2335 0.4626
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0188 0.0782 0.0833
Echinococcus granulosus activin receptor type 0.006 0.0044 0.0043
Loa Loa (eye worm) fructose-1,6-bisphosphatase 0.0927 0.5048 0.5383
Toxoplasma gondii facilitative glucose transporter GT1 0.0102 0.0285 0.0562
Loa Loa (eye worm) hypothetical protein 0.0156 0.0595 0.0634
Loa Loa (eye worm) hypothetical protein 0.0105 0.0301 0.032
Loa Loa (eye worm) CMGC/DYRK/DYRK1 protein kinase 0.0457 0.2335 0.249
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0105 0.0301 0.201
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0102 0.0284 0.1893
Loa Loa (eye worm) TK/FER protein kinase 0.0082 0.0168 0.0178
Echinococcus granulosus tyrosine protein kinase ABL1 0.0082 0.0168 0.0167
Echinococcus granulosus tyrosine protein kinase Fyn 0.0188 0.0782 0.0782
Trypanosoma brucei fructose-1,6-bisphosphatase 0.0927 0.5048 1
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.017 0.0676 0.0675
Echinococcus multilocularis tyrosine protein kinase Blk 0.017 0.0676 0.072
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.0285 0.0284
Schistosoma mansoni tyrosine kinase 0.0082 0.0168 0.0179
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0102 0.0284 0.056
Entamoeba histolytica protein kinase, putative 0.0457 0.2335 1
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0188 0.0782 0.0782
Echinococcus granulosus cyclin dependent kinase 5 0.0266 0.1231 0.123
Loa Loa (eye worm) hypothetical protein 0.0075 0.0132 0.014
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Echinococcus multilocularis hemicentin 1 0.0084 0.0181 0.0192
Echinococcus granulosus hemicentin 1 0.0084 0.0181 0.018
Plasmodium vivax protein kinase, putative 0.0057 0.0025 0.0164
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0266 0.1231 0.123
Echinococcus granulosus dual specificity protein kinase clk2 0.0311 0.1494 0.1493
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0053 0.0001 0.0001
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0077 0.0144 0.0152
Schistosoma mansoni protein kinase 0.006 0.0044 0.0047
Brugia malayi Immunoglobulin I-set domain containing protein 0.0075 0.0132 0.0141
Echinococcus granulosus dual specificity 0.0457 0.2335 0.2335
Schistosoma mansoni vesicular amine transporter 0.0156 0.0595 0.0635
Loa Loa (eye worm) hypothetical protein 0.0105 0.0301 0.032
Echinococcus granulosus lachesin 0.0075 0.0132 0.0131
Brugia malayi cell division control protein 2 homolog 0.0266 0.1231 0.1313
Echinococcus multilocularis c src tyrosine kinase 0.01 0.0274 0.0291
Brugia malayi ephrin receptor 1 precursor 0.0078 0.0148 0.0157
Brugia malayi Tyrosine-protein kinase F09A5.2 in chromosome X, putative 0.0053 0.0001 0.0001
Loa Loa (eye worm) TK/FER protein kinase 0.0082 0.0168 0.0178
Loa Loa (eye worm) TK/FER protein kinase 0.0082 0.0168 0.0178
Entamoeba histolytica protein kinase domain containing protein 0.0457 0.2335 1
Loa Loa (eye worm) TK protein kinase 0.0182 0.0744 0.0793
Echinococcus multilocularis expressed conserved protein 0.0081 0.0162 0.0171
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Loa Loa (eye worm) sugar transporter 0.0102 0.0285 0.0303
Brugia malayi Protein kinase domain containing protein 0.0082 0.0168 0.0179
Loa Loa (eye worm) hypothetical protein 0.0304 0.1451 0.1547
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0105 0.0301 0.032
Brugia malayi hypothetical protein 0.0053 0.0001 0.0001
Entamoeba histolytica cell division protein kinase 2, putative 0.0266 0.1231 0.5269
Echinococcus multilocularis neuroglian 0.0187 0.0776 0.0827
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Loa Loa (eye worm) TK/FER protein kinase 0.0082 0.0168 0.0178
Echinococcus granulosus tyrosine protein kinase transmembrane receptor 0.0084 0.0182 0.0181
Echinococcus multilocularis epidermal growth factor receptor 0.0973 0.5315 0.5667
Brugia malayi Immunoglobulin I-set domain containing protein 0.0077 0.0144 0.0153
Echinococcus multilocularis tyrosine protein kinase Fps85D 0.0082 0.0168 0.0178
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Plasmodium falciparum protoporphyrinogen oxidase 0.0105 0.0301 0.201
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0077 0.0144 0.0153
Echinococcus multilocularis roundabout 2 0.0077 0.0144 0.0152
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0102 0.0284 0.0302
Loa Loa (eye worm) TK/FER protein kinase 0.0082 0.0168 0.0178
Echinococcus multilocularis cyclin dependent kinase 0.0266 0.1231 0.1312
Schistosoma mansoni septate junction protein 0.0075 0.0132 0.0141
Echinococcus multilocularis insulin receptor 0.0563 0.2948 0.3143
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0102 0.0284 0.1893
Echinococcus multilocularis lachesin 0.0075 0.0132 0.014
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0102 0.0284 0.1211
Schistosoma mansoni glucose transport protein 0.0102 0.0285 0.0304
Brugia malayi Probable tyrosine-protein kinase kin-31 0.0053 0.0001 0.0001
Brugia malayi Immunoglobulin I-set domain containing protein 0.0075 0.0132 0.0141
Echinococcus granulosus tyrosine protein kinase Fyn 0.0188 0.0782 0.0782
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0102 0.0285 0.0303
Loa Loa (eye worm) hypothetical protein 0.0158 0.0607 0.0646
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0102 0.0285 0.0303
Brugia malayi Protein kinase domain containing protein 0.0563 0.2948 0.3144
Echinococcus granulosus cyclin dependent kinase 5 activator 1 0.1296 0.7179 0.7179
Echinococcus granulosus hypothetical protein 0.0304 0.1451 0.145
Brugia malayi C-terminal src kinase protein 1 0.0053 0.0001 0.0001
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Schistosoma mansoni tyrosine kinase 0.0921 0.501 0.5343
Echinococcus multilocularis 0.0583 0.306 0.3263
Onchocerca volvulus 0.0082 0.0168 0.0245
Entamoeba histolytica protein kinase domain containing protein 0.006 0.0044 0.0184
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0188 0.0782 0.0833
Leishmania major serine/threonine-protein kinase, putative,protein kinase, putative 0.0457 0.2335 0.4626
Echinococcus multilocularis protoporphyrinogen oxidase 0.0105 0.0301 0.032
Echinococcus multilocularis General substrate transporter 0.0088 0.0202 0.0214
Echinococcus granulosus expressed conserved protein 0.0081 0.0162 0.0161
Echinococcus multilocularis Immunoglobulin 0.0156 0.0595 0.0634
Schistosoma mansoni tyrosine kinase 0.0921 0.501 0.5343
Brugia malayi Immunoglobulin I-set domain containing protein 0.1396 0.7752 0.8267
Echinococcus granulosus epidermal growth factor receptor 0.1677 0.9377 0.9377
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0266 0.1231 0.2437
Loa Loa (eye worm) hypothetical protein 0.0075 0.0132 0.014
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Entamoeba histolytica hypothetical protein 0.0102 0.0284 0.1211
Trypanosoma cruzi sedoheptulose-1,7-bisphosphatase, putative 0.0345 0.1687 0.334
Brugia malayi Protein kinase domain containing protein 0.0082 0.0168 0.0179
Echinococcus multilocularis 0.0105 0.0301 0.032
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0565 0.296 0.2959
Schistosoma mansoni cell adhesion molecule 0.0077 0.0144 0.0153
Schistosoma mansoni serine/threonine protein kinase 0.0266 0.1231 0.1313
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Schistosoma mansoni protein kinase 0.0053 0.0001 0.0001
Trypanosoma brucei cdc2-related kinase 3 0.0266 0.1231 0.2437
Trypanosoma cruzi cdc2-related kinase 3 0.0266 0.1231 0.2437
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0095 0.0248 0.1057
Echinococcus granulosus roundabout 2 0.0077 0.0144 0.0143
Loa Loa (eye worm) hypothetical protein 0.0621 0.3278 0.3496
Trypanosoma brucei sedoheptulose-1,7-bisphosphatase 0.0345 0.1687 0.334
Onchocerca volvulus 0.0082 0.0168 0.0245
Plasmodium vivax hexose transporter 0.0102 0.0285 0.19
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0266 0.1231 0.2437
Plasmodium vivax hypothetical protein, conserved 0.0105 0.0301 0.201
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0077 0.0144 0.0143
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0102 0.0285 0.0303
Loa Loa (eye worm) TK protein kinase 0.017 0.0676 0.072
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Trichomonas vaginalis CMGC family protein kinase 0.0266 0.1231 0.8239
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0117 0.0372 0.0396
Echinococcus multilocularis ephrin type A receptor 4 A 0.0119 0.0386 0.0411
Echinococcus granulosus tyrosine protein kinase Btk29A 0.01 0.0274 0.0273
Brugia malayi Tyrosine-protein kinase abl-1 0.01 0.0274 0.0292
Echinococcus multilocularis tyrosine kinase 0.0082 0.0168 0.0178
Schistosoma mansoni tyrosine kinase 0.0188 0.0782 0.0834
Leishmania major protein kinase, putative 0.0311 0.1494 0.2958
Echinococcus granulosus roundabout 2 0.0077 0.0144 0.0143
Entamoeba histolytica protein kinase, putative 0.0457 0.2335 1
Brugia malayi Raf kinase 0.0053 0.0001 0.0001
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Echinococcus granulosus phosphatidylinositol 3 kinase regulatory subunit 0.011 0.0329 0.0328
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Brugia malayi Protein kinase domain containing protein 0.0266 0.1231 0.1313
Schistosoma mansoni protein kinase 0.006 0.0044 0.0047
Trypanosoma cruzi kinetoplastid kinetochore protein 19, putative 0.0311 0.1494 0.2958
Echinococcus granulosus tyrosine protein kinase Srms 0.0082 0.0168 0.0167
Echinococcus multilocularis cyclin dependent kinase 1 0.0266 0.1231 0.1312
Trypanosoma cruzi kinetoplastid kinetochore protein 19, putative 0.0311 0.1494 0.2958
Loa Loa (eye worm) TK/ALK protein kinase 0.0295 0.1399 0.1491
Echinococcus multilocularis tyrosine protein kinase ABL1 0.0082 0.0168 0.0178
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.0105 0.0301 0.0595
Echinococcus multilocularis microtubule associated protein 2 0.067 0.3563 0.3799
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0973 0.5315 0.5314
Loa Loa (eye worm) CMGC/CLK protein kinase 0.0311 0.1494 0.1593
Echinococcus granulosus cyclin dependent kinase 1 0.0266 0.1231 0.123
Leishmania major protein kinase, putative 0.006 0.0044 0.0085
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.0285 0.0284
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0102 0.0284 0.0283
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Echinococcus granulosus lysine specific histone demethylase 1A 0.0105 0.0301 0.03
Loa Loa (eye worm) TK/EGFR protein kinase 0.1677 0.9377 1
Onchocerca volvulus Basement membrane proteoglycan homolog 0.0084 0.0181 0.0264
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0188 0.0782 0.0833
Loa Loa (eye worm) hypothetical protein 0.0075 0.0132 0.014
Brugia malayi Protein kinase domain containing protein 0.0082 0.0168 0.0179
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0565 0.296 0.3156
Schistosoma mansoni tyrosine kinase 0.0921 0.501 0.5343
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0075 0.0132 0.014
Loa Loa (eye worm) TK/INSR protein kinase 0.0563 0.2948 0.3143
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0156 0.0595 0.0635
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Echinococcus granulosus defective proboscis extension response 0.0156 0.0595 0.0594
Echinococcus granulosus tyrosine protein kinase Src64B 0.0188 0.0782 0.0782
Schistosoma mansoni ephrin receptor 0.0107 0.0312 0.0333
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Echinococcus multilocularis dual specificity testis specific protein kinase 0.006 0.0044 0.0046
Loa Loa (eye worm) TK/FER protein kinase 0.0082 0.0168 0.0178
Brugia malayi Immunoglobulin I-set domain containing protein 0.0077 0.0144 0.0153
Echinococcus multilocularis neurotracting:lsamp:neurotrimin:obcam 0.0075 0.0132 0.014
Brugia malayi Immunoglobulin I-set domain containing protein 0.0075 0.0132 0.0141
Brugia malayi fructose-1,6-bisphosphatase 0.0927 0.5048 0.5384
Schistosoma mansoni tyrosine kinase 0.0188 0.0782 0.0834
Trypanosoma cruzi cdc2-related kinase 1 0.0266 0.1231 0.2437
Schistosoma mansoni protein kinase 0.0053 0.0001 0.0001
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Echinococcus granulosus peroxidasin 0.0075 0.0132 0.0131
Brugia malayi hypothetical protein 0.0621 0.3278 0.3496
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0102 0.0285 0.0303
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Schistosoma mansoni tyrosine kinase 0.015 0.0563 0.0601
Loa Loa (eye worm) TK/FER protein kinase 0.0082 0.0168 0.0178
Brugia malayi Immunoglobulin I-set domain containing protein 0.0075 0.0132 0.0141
Brugia malayi Immunoglobulin I-set domain containing protein 0.0077 0.0144 0.0153
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0102 0.0284 0.1893
Loa Loa (eye worm) TK protein kinase 0.0141 0.0509 0.0542
Brugia malayi Probable tyrosine-protein kinase kin-31 0.0053 0.0001 0.0001
Onchocerca volvulus 0.0082 0.0168 0.0245
Loa Loa (eye worm) phosphatidylinositol 3 0.0102 0.0284 0.0302
Echinococcus granulosus tyrosine protein kinase otk 0.0075 0.0132 0.0131
Schistosoma mansoni nephrin 0.0189 0.0788 0.084
Schistosoma mansoni protein kinase 0.0053 0.0001 0.0001
Echinococcus granulosus tyrosine protein kinase Fps85D 0.0082 0.0168 0.0167
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.02 0.085 0.0849
Schistosoma mansoni protein kinase 0.0053 0.0001 0.0001
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.01 0.0274 0.0292
Schistosoma mansoni ephrin receptor 0.0055 0.0013 0.0013
Echinococcus granulosus tyrosine kinase 0.0082 0.0168 0.0167
Schistosoma mansoni cell adhesion molecule 0.0202 0.0861 0.0919
Loa Loa (eye worm) hypothetical protein 0.0105 0.0301 0.032
Trichomonas vaginalis conserved hypothetical protein 0.0102 0.0285 0.19
Schistosoma mansoni tyrosine protein kinase fes (fps) (ptk group IV) 0.0053 0.0001 0.0001
Leishmania major UDP-galactopyranose mutase 0.0105 0.0301 0.0595
Brugia malayi Protein kinase domain containing protein 0.0082 0.0168 0.0179
Schistosoma mansoni tyrosine-protein kinase fps85d 0.0053 0.0001 0.0001
Brugia malayi Tyrosine-protein kinase PR2 0.0053 0.0001 0.0001
Trypanosoma brucei protein kinase, putative 0.006 0.0044 0.0085
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Echinococcus granulosus fibroblast growth factor receptor 4 0.015 0.0563 0.0562
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.0285 0.0284
Loa Loa (eye worm) TK/FER protein kinase 0.0082 0.0168 0.0178
Loa Loa (eye worm) hypothetical protein 0.0158 0.0607 0.0646
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0266 0.1231 0.2437
Toxoplasma gondii histone lysine-specific demethylase 0.0105 0.0301 0.0595
Trypanosoma brucei STE/STE11 serine/threonine-protein kinase, putative 0.006 0.0044 0.0085
Schistosoma mansoni serine/threonine protein kinase 0.0266 0.1231 0.1313
Giardia lamblia Kinase, CMGC CLK 0.0311 0.1494 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0075 0.0132 0.0141
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Echinococcus multilocularis tyrosine protein kinase transmembrane receptor 0.0084 0.0182 0.0193
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0075 0.0132 0.014
Schistosoma mansoni protein tyrosine kinase 0.0053 0.0001 0.0001
Schistosoma mansoni protein kinase 0.0053 0.0001 0.0001
Echinococcus granulosus microtubule associated protein 2 0.067 0.3563 0.3562
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0102 0.0284 0.0302
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0077 0.0144 0.0152
Loa Loa (eye worm) hypothetical protein 0.0105 0.0301 0.032
Trypanosoma cruzi UDP-galactopyranose mutase 0.0105 0.0301 0.0595
Schistosoma mansoni septate junction protein 0.0075 0.0132 0.0141
Entamoeba histolytica protein kinase, putative 0.0141 0.0509 0.2177
Plasmodium vivax serine/threonine kinase-1, putative 0.0311 0.1494 1
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0156 0.0595 0.0634
Trypanosoma cruzi fructose-1,6-bisphosphatase, cytosolic, putative 0.0927 0.5048 1
Brugia malayi Adenylate and Guanylate cyclase catalytic domain containing protein 0.0053 0.0001 0.0001
Echinococcus multilocularis tyrosine protein kinase Srms 0.017 0.0676 0.072
Trypanosoma cruzi fructose-1,6-bisphosphatase, cytosolic, putative 0.0927 0.5048 1
Schistosoma mansoni tyrosine kinase 0.01 0.0274 0.0292
Brugia malayi Protein kinase domain containing protein 0.0053 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0156 0.0595 0.0634
Schistosoma mansoni glucose transport protein 0.0102 0.0285 0.0304
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0188 0.0782 0.0782
Loa Loa (eye worm) hypothetical protein 0.0075 0.0132 0.014
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.0105 0.0301 0.0321
Toxoplasma gondii sedoheptulose-1,7-bisphosphatase 0.0345 0.1687 0.334
Echinococcus multilocularis cyclin dependent kinase 5 activator 1 0.1296 0.7179 0.7656
Schistosoma mansoni nephrin 0.0077 0.0144 0.0153
Echinococcus granulosus lysine specific histone demethylase 1A 0.0105 0.0301 0.03
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0266 0.1231 0.1312
Schistosoma mansoni hypothetical protein 0.0081 0.0162 0.0172
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0266 0.1231 0.1312
Loa Loa (eye worm) hypothetical protein 0.0258 0.1188 0.1266
Loa Loa (eye worm) hypothetical protein 0.0054 0.0008 0.0007
Schistosoma mansoni tyrosine kinase 0.0563 0.2948 0.3144
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0102 0.0284 0.1893
Schistosoma mansoni microtubule-associated protein tau 0.067 0.3563 0.3799
Onchocerca volvulus 0.0082 0.0168 0.0245
Echinococcus granulosus twitchin 0.0195 0.0819 0.0819
Loa Loa (eye worm) TK/FER protein kinase 0.0082 0.0168 0.0178
Loa Loa (eye worm) hypothetical protein 0.045 0.2292 0.2444
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.006 0.0044 0.0085
Echinococcus multilocularis cyclin dependent kinase 5 0.0266 0.1231 0.1312
Trypanosoma cruzi cdc2-related kinase 3 0.0266 0.1231 0.2437
Echinococcus multilocularis cyclin dependent kinase 1 0.0266 0.1231 0.1312
Plasmodium vivax lysine-specific histone demethylase 1, putative 0.0105 0.0301 0.201
Echinococcus granulosus roundabout 2 0.0233 0.1042 0.1042
Echinococcus multilocularis tyrosine protein kinase Abl 0.01 0.0274 0.0291
Echinococcus multilocularis neuroglian 0.0077 0.0144 0.0152
Onchocerca volvulus 0.0082 0.0168 0.0245
Echinococcus granulosus fructose 16 bisphosphatase 1 0.0927 0.5048 0.5048
Trypanosoma brucei kinetoplastid kinetochore protein 10 0.0311 0.1494 0.2958
Trichomonas vaginalis CMGC family protein kinase 0.0266 0.1231 0.8239
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Brugia malayi amine oxidase, flavin-containing family protein 0.0105 0.0301 0.0321
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.01 0.0274 0.0291
Schistosoma mansoni protein kinase 0.0053 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0077 0.0144 0.0152
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Schistosoma mansoni protein kinase 0.0053 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0074 0.0125 0.0132
Schistosoma mansoni hypothetical protein 0.0102 0.0285 0.0304
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Schistosoma mansoni amine oxidase 0.0105 0.0301 0.0321
Schistosoma mansoni titin 0.0084 0.0181 0.0193
Plasmodium falciparum protein serine/threonine kinase-1 0.0311 0.1494 1
Echinococcus granulosus c src tyrosine kinase 0.01 0.0274 0.0273
Schistosoma mansoni amine oxidase 0.0105 0.0301 0.0321
Loa Loa (eye worm) hypothetical protein 0.036 0.1774 0.1891
Echinococcus multilocularis hemicentin 1 0.0075 0.0132 0.014
Loa Loa (eye worm) TK/EPH protein kinase 0.0121 0.0397 0.0423
Echinococcus multilocularis fibroblast growth factor receptor 4 0.015 0.0563 0.06
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.0285 0.0284
Plasmodium falciparum protein kinase 5 0.0266 0.1231 0.8239
Schistosoma mansoni tyrosine kinase 0.0973 0.5315 0.5668
Onchocerca volvulus 0.1143 0.6295 0.9217
Chlamydia trachomatis protoporphyrinogen oxidase 0.0105 0.0301 0.5
Schistosoma mansoni serine/threonine protein kinase 0.0311 0.1494 0.1593
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.0001 0.0001
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Schistosoma mansoni glucose transport protein 0.0102 0.0285 0.0304
Brugia malayi Immunoglobulin I-set domain containing protein 0.0158 0.0607 0.0647
Loa Loa (eye worm) TK/ABL protein kinase 0.0082 0.0168 0.0178
Echinococcus granulosus tyrosine protein kinase Fyn 0.0188 0.0782 0.0782
Brugia malayi Immunoglobulin I-set domain containing protein 0.0075 0.0132 0.0141
Loa Loa (eye worm) hypothetical protein 0.0105 0.0301 0.032
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0188 0.0782 0.0833
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.0457 0.2335 0.4626
Echinococcus granulosus insulin receptor 0.0563 0.2948 0.2948
Loa Loa (eye worm) hypothetical protein 0.0105 0.0301 0.032
Brugia malayi Protein kinase domain containing protein 0.0457 0.2335 0.2491
Brugia malayi Guanylyl cyclase protein 23 0.0053 0.0001 0.0001
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0102 0.0284 0.1211
Echinococcus multilocularis activin receptor type 0.006 0.0044 0.0046
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.0457 0.2335 0.4626
Schistosoma mansoni serine/threonine protein kinase 0.0457 0.2335 0.2491
Schistosoma mansoni serine/threonine protein kinase 0.0311 0.1494 0.1593
Brugia malayi hypothetical protein 0.0053 0.0001 0.0001
Echinococcus granulosus tyrosine protein kinase shark 0.0082 0.0168 0.0167
Echinococcus multilocularis tyrosine protein kinase otk 0.0075 0.0132 0.014
Echinococcus multilocularis contactin neuroglian septate junction protein 0.0077 0.0144 0.0152
Schistosoma mansoni tyrosine protein kinase 0.0053 0.0001 0.0001
Echinococcus granulosus neuroglian 0.0077 0.0144 0.0143
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0188 0.0782 0.0833
Brugia malayi bone morphogenetic protein type 1 receptor 0.0053 0.0001 0.0001
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0102 0.0284 0.1893
Plasmodium vivax hypothetical protein, conserved 0.0105 0.0301 0.201
Echinococcus multilocularis tyrosine protein kinase HCK 0.0141 0.0509 0.0542
Leishmania major 0.0927 0.5048 1
Schistosoma mansoni serine/threonine RGC 0.0053 0.0001 0.0001
Brugia malayi integrin-linked kinase 0.0053 0.0001 0.0001
Trypanosoma brucei kinetoplastid kinetochore protein 19 0.0311 0.1494 0.2958
Schistosoma mansoni protein kinase 0.0053 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0213 0.0927 0.0988
Schistosoma mansoni fructose-16-bisphosphatase-related 0.0927 0.5048 0.5384
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0075 0.0132 0.014
Toxoplasma gondii fructose-bisphospatase I 0.0345 0.1687 0.334
Brugia malayi hypothetical protein 0.0105 0.0301 0.0321
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Schistosoma mansoni serine/threonine protein kinase 0.0071 0.0107 0.0114
Echinococcus granulosus dual specificity testis-specific protein kinase 0.006 0.0044 0.0043
Echinococcus multilocularis dual specificity 0.0457 0.2335 0.249
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.0001 0.0001
Mycobacterium leprae PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO) 0.0105 0.0301 0.5
Trichomonas vaginalis CMGC family protein kinase 0.0311 0.1494 1
Loa Loa (eye worm) hypothetical protein 0.045 0.2292 0.2444
Loa Loa (eye worm) hypothetical protein 0.0075 0.0132 0.014
Schistosoma mansoni tyrosine kinase 0.0973 0.5315 0.5668
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.1487 0.8281 1
Schistosoma mansoni neuroglian 0.0077 0.0144 0.0153
Plasmodium vivax protoporphyrinogen oxidase, putative 0.0105 0.0301 0.201
Schistosoma mansoni tyrosine kinase 0.0053 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.02 0.085 0.0905
Schistosoma mansoni hypothetical protein 0.0053 0.0001 0.0001
Echinococcus multilocularis epidermal growth factor receptor 0.1677 0.9377 1
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.0001 0.0001
Brugia malayi hypothetical protein 0.0082 0.0168 0.0179

Activities

Activity type Activity value Assay description Source Reference
CC50 (ADMET) > 100 ug ml-1 Cytotoxicity against HIV1 infected human C8166-CCR5 cells assessed as decrease in cell viability by cell associated dehydrogenase activity assay ChEMBL. 19515569

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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