Detailed information for compound 1655682

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 558.539 | Formula: C29H26N4O8
  • H donors: 1 H acceptors: 4 LogP: 3.29 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 2
  • SMILES: COc1cc(cc(c1OC)OC)[C@H]1[C@H]2C(=O)OC[C@@H]2[C@@H](c2c1cc1OCOc1c2)Nc1nnc(o1)c1ccncc1
  • InChi: 1S/C29H26N4O8/c1-35-21-8-15(9-22(36-2)26(21)37-3)23-16-10-19-20(40-13-39-19)11-17(16)25(18-12-38-28(34)24(18)23)31-29-33-32-27(41-29)14-4-6-30-7-5-14/h4-11,18,23-25H,12-13H2,1-3H3,(H,31,33)/t18-,23+,24-,25+/m0/s1
  • InChiKey: QLSANHZWTKBKOJ-LVEBQJTPSA-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 multilocularis nervana 2 0.0071 0.1874 0.1874
Schistosoma mansoni serine/threonine protein kinase 0.004 0.0913 0.0913
Brugia malayi Protein kinase domain containing protein 0.0176 0.5152 0.5152
Loa Loa (eye worm) hypothetical protein 0.0012 0.0038 0.0038
Entamoeba histolytica SH2-protein kinase domain containing protein 0.0015 0.0157 0.0175
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0044 0.1049 0.3314
Plasmodium falciparum NADPH--cytochrome P450 reductase, putative 0.0019 0.0258 0.1168
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0022 0.0358 0.0358
Entamoeba histolytica protein kinase, putative 0.0116 0.3282 0.4431
Schistosoma mansoni serine/threonine protein kinase 0.004 0.0913 0.0913
Echinococcus granulosus tyrosine protein kinase Src42A 0.0018 0.0236 0.0236
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0026 0.0477 0.0477
Schistosoma mansoni tyrosine kinase 0.0015 0.0161 0.0161
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0022 0.0358 0.0358
Brugia malayi Steroid receptor seven-up type 2 0.0022 0.0358 0.0358
Echinococcus multilocularis serine threonine protein kinase nrc serine threonine protein kinase gad 0.0074 0.1988 0.1988
Brugia malayi hypothetical protein 0.0015 0.0157 0.0157
Brugia malayi Fibronectin type III domain containing protein 0.0026 0.0477 0.0477
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.004 0.0913 0.0913
Onchocerca volvulus Netrin receptor homolog 0.0017 0.0197 0.0197
Schistosoma mansoni inositol monophosphatase 0.0041 0.0952 0.0952
Brugia malayi Inositol-1 0.0041 0.0952 0.0952
Trypanosoma brucei S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0019 0.0258 0.0312
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.0952 0.1257
Loa Loa (eye worm) hypothetical protein 0.0086 0.235 0.235
Leishmania major p450 reductase, putative 0.0049 0.119 0.1581
Loa Loa (eye worm) TK/FER protein kinase 0.0015 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.0022 0.0358 0.0358
Brugia malayi flavodoxin family protein 0.0049 0.119 0.119
Echinococcus granulosus FTZ F1 alpha 0.0022 0.0358 0.0358
Echinococcus multilocularis activin receptor type 0.0011 0.0029 0.0029
Onchocerca volvulus Serine\/threonine protein kinase homolog 0.0332 1 1
Schistosoma mansoni tyrosine kinase 0.0018 0.0236 0.0236
Onchocerca volvulus 0.0086 0.235 0.235
Schistosoma mansoni serine/threonine protein kinase 0.004 0.0913 0.0913
Brugia malayi Protein kinase domain containing protein 0.004 0.0913 0.0913
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0018 0.0236 0.0236
Echinococcus granulosus L aminoadipate semialdehyde 0.0086 0.235 0.235
Schistosoma mansoni serine/threonine protein kinase 0.004 0.0913 0.0913
Echinococcus multilocularis Glutaredoxin protein 5 0.0071 0.1874 0.1874
Onchocerca volvulus Tyrosine kinase homolog 0.0153 0.4424 0.4424
Schistosoma mansoni serine/threonine protein kinase 0.004 0.0913 0.0913
Trichomonas vaginalis AGC family protein kinase 0.004 0.0913 0.0921
Toxoplasma gondii flavodoxin domain-containing protein 0.0024 0.0429 0.1301
Trypanosoma brucei rac serine-threonine kinase, putative 0.0116 0.3282 0.4431
Loa Loa (eye worm) hypothetical protein 0.0015 0.0157 0.0157
Entamoeba histolytica type A flavoprotein, putative 0.0019 0.0258 0.0312
Echinococcus granulosus NADPH dependent diflavin oxidoreductase 1 0.0049 0.119 0.119
Schistosoma mansoni protein kinase 0.0011 0.0029 0.0029
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0014 0.0121 0.0121
Loa Loa (eye worm) CAMK/PIM protein kinase 0.0332 1 1
Echinococcus multilocularis serine:threonine protein kinase 38 0.004 0.0913 0.0913
Echinococcus granulosus tyrosine protein kinase ABL1 0.0015 0.0157 0.0157
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0041 0.0952 0.0975
Trichomonas vaginalis sulfite reductase, putative 0.0049 0.119 0.1311
Echinococcus granulosus dual specificity testis-specific protein kinase 0.0011 0.0029 0.0029
Brugia malayi hypothetical protein 0.0012 0.0038 0.0038
Schistosoma mansoni nuclear hormone receptor 0.0022 0.0358 0.0358
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0041 0.0952 0.1257
Loa Loa (eye worm) SRC-1 0.0018 0.0236 0.0236
Loa Loa (eye worm) TK/FER protein kinase 0.0015 0.0157 0.0157
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.015 0.4334 0.4334
Onchocerca volvulus 0.0015 0.0157 0.0157
Echinococcus granulosus Immunoglobulin 0.0026 0.0477 0.0477
Loa Loa (eye worm) FAD binding domain-containing protein 0.0049 0.119 0.119
Loa Loa (eye worm) TK/FER protein kinase 0.0015 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.0022 0.0358 0.0358
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0026 0.0477 0.0477
Brugia malayi Tyrosine-protein kinase abl-1 0.0018 0.0236 0.0236
Echinococcus granulosus inositol monophosphatase 1 0.0041 0.0952 0.0952
Onchocerca volvulus 0.0015 0.0157 0.0157
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0022 0.0358 0.0358
Echinococcus multilocularis serine threonine protein kinase 0.004 0.0913 0.0913
Schistosoma mansoni tyrosine kinase 0.0018 0.0236 0.0236
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0022 0.0358 0.0358
Schistosoma mansoni tyrosine kinase 0.0013 0.0089 0.0089
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0022 0.0358 0.0358
Brugia malayi photoreceptor-specific nuclear receptor 0.0022 0.0358 0.0358
Entamoeba histolytica protein kinase, putative 0.0116 0.3282 0.4431
Loa Loa (eye worm) hypothetical protein 0.0026 0.0477 0.0477
Schistosoma mansoni serine/threonine protein kinase 0.004 0.0913 0.0913
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0024 0.0431 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0477 0.0477
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0015 0.0157 0.0157
Schistosoma mansoni steroid hormone receptor ad4bp 0.0022 0.0358 0.0358
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0548 0.1677
Brugia malayi Immunoglobulin I-set domain containing protein 0.0017 0.0218 0.0218
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0022 0.0358 0.0358
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0018 0.0236 0.0236
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0022 0.0358 0.0358
Brugia malayi Serine/threonine-protein kinase Pim-3 0.0332 1 1
Entamoeba histolytica type A flavoprotein, putative 0.0019 0.0258 0.0312
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0024 0.0431 0.2053
Trichomonas vaginalis CAMK family protein kinase 0.0247 0.7372 1
Schistosoma mansoni inositol monophosphatase 0.0041 0.0952 0.0952
Loa Loa (eye worm) hypothetical protein 0.0012 0.0038 0.0038
Echinococcus granulosus serine threonine protein kinase nrc 0.0074 0.1988 0.1988
Echinococcus multilocularis NADPH cytochrome P450 reductase 0.0049 0.119 0.119
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0548 0.0707
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0013 0.0069 0.0069
Loa Loa (eye worm) TK/FER protein kinase 0.0015 0.0157 0.0157
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.004 0.0913 0.0913
Trichomonas vaginalis CAMK family protein kinase 0.0247 0.7372 1
Plasmodium falciparum histone acetyltransferase GCN5 0.004 0.0935 0.4625
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0014 0.0121 0.0121
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0022 0.0358 0.0358
Echinococcus multilocularis tyrosine protein kinase ABL1 0.0015 0.0157 0.0157
Brugia malayi hypothetical protein 0.0026 0.0477 0.0477
Loa Loa (eye worm) hypothetical protein 0.004 0.0913 0.0913
Loa Loa (eye worm) steroid hormone receptor 0.0022 0.0358 0.0358
Plasmodium falciparum RAC-beta serine/threonine protein kinase 0.0074 0.1988 1
Trypanosoma cruzi polo-like protein kinase, putative 0.0247 0.7372 1
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0029 0.0574 0.0574
Schistosoma mansoni vav2 0.0013 0.0097 0.0097
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0022 0.0358 0.0358
Brugia malayi Nuclear hormone receptor-like 1 0.0012 0.0038 0.0038
Loa Loa (eye worm) TK/EGFR protein kinase 0.0161 0.4677 0.4677
Schistosoma mansoni hypothetical protein 0.0013 0.0069 0.0069
Echinococcus multilocularis netrin receptor unc 5 0.0017 0.0218 0.0218
Schistosoma mansoni protein kinase 0.0011 0.0029 0.0029
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0155 0.4495 0.4495
Trichomonas vaginalis NADPH fad oxidoreductase, putative 0.0043 0.1018 0.1069
Echinococcus granulosus nervana 2 0.0071 0.1874 0.1874
Loa Loa (eye worm) hypothetical protein 0.0022 0.0358 0.0358
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0049 0.119 0.1581
Loa Loa (eye worm) hypothetical protein 0.0031 0.065 0.065
Onchocerca volvulus 0.0015 0.0157 0.0157
Plasmodium vivax flavodoxin domain containing protein 0.0043 0.1018 0.4397
Leishmania major hypothetical protein, conserved 0.0028 0.0548 0.0707
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0247 0.7372 0.7372
Entamoeba histolytica type A flavoprotein, putative 0.0019 0.0258 0.0312
Brugia malayi SRC-1 0.0018 0.0236 0.0236
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.004 0.0913 0.0913
Trichomonas vaginalis CAMK family protein kinase 0.0247 0.7372 1
Echinococcus multilocularis neuroglian 0.0028 0.0553 0.0553
Trypanosoma brucei NADPH-dependent diflavin oxidoreductase 1 0.0049 0.119 0.1581
Echinococcus granulosus calcium:calmodulin dependent protein kinase 0.0074 0.1988 0.1988
Loa Loa (eye worm) FAD binding domain-containing protein 0.003 0.0612 0.0612
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0022 0.0358 0.0358
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0049 0.119 0.1581
Echinococcus granulosus protein kinase C gamma type 0.004 0.0913 0.0913
Loa Loa (eye worm) hypothetical protein 0.0022 0.0358 0.0358
Trypanosoma brucei hypothetical protein, conserved 0.0024 0.0431 0.0548
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0037 0.0818 1
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.0952 0.1257
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0022 0.0358 0.0358
Entamoeba histolytica protein kinase, putative 0.004 0.0913 0.1204
Brugia malayi serine/threonine-protein kinase plk-2 0.0247 0.7372 0.7372
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.004 0.0913 0.0913
Loa Loa (eye worm) hypothetical protein 0.0012 0.0038 0.0038
Schistosoma mansoni tyrosine kinase 0.0056 0.1418 0.1418
Schistosoma mansoni cell adhesion molecule 0.0029 0.0574 0.0574
Loa Loa (eye worm) hypothetical protein 0.0026 0.0477 0.0477
Trichomonas vaginalis CAMK family protein kinase 0.0247 0.7372 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.0044 0.1049 0.1049
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0071 0.1874 0.1874
Brugia malayi protein kinase C II. 0.004 0.0913 0.0913
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0018 0.0236 0.0236
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0022 0.0358 0.0358
Schistosoma mansoni serine/threonine-protein kinase 0.008 0.2163 0.2163
Loa Loa (eye worm) CAMK/CAMKL/CHK1 protein kinase 0.0176 0.5152 0.5152
Echinococcus granulosus defective proboscis extension response 0.0026 0.0477 0.0477
Entamoeba histolytica protein kinase, putative 0.011 0.3107 0.4191
Echinococcus granulosus neuroglian 0.0028 0.0553 0.0553
Giardia lamblia Nitric oxide synthase, inducible 0.0043 0.1018 0.013
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0018 0.0236 0.0236
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0022 0.0358 0.0358
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0086 0.235 0.235
Schistosoma mansoni NADPH flavin oxidoreductase 0.0024 0.0441 0.0441
Schistosoma mansoni tyrosine kinase 0.0082 0.2226 0.2226
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0013 0.0097 0.0097
Echinococcus multilocularis tyrosine protein kinase Srms 0.0015 0.0157 0.0157
Trichomonas vaginalis inositol monophosphatase, putative 0.0041 0.0952 0.0975
Echinococcus multilocularis FTZ F1 alpha 0.0022 0.0358 0.0358
Loa Loa (eye worm) TK/FER protein kinase 0.0015 0.0157 0.0157
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0247 0.7372 0.7372
Echinococcus granulosus NADPH cytochrome P450 reductase 0.0049 0.119 0.119
Brugia malayi nuclear receptor NHR-88 0.0022 0.0358 0.0358
Echinococcus multilocularis tyrosine kinase 0.0015 0.0157 0.0157
Echinococcus granulosus epidermal growth factor receptor 0.0161 0.4677 0.4677
Echinococcus multilocularis Serine:threonine protein kinase PLK4 0.0119 0.3366 0.3366
Echinococcus granulosus tyrosine protein kinase Fps85D 0.0015 0.0157 0.0157
Loa Loa (eye worm) TK protein kinase 0.0015 0.0157 0.0157
Loa Loa (eye worm) TK/FER protein kinase 0.0015 0.0157 0.0157
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0022 0.0358 0.0358
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0049 0.119 0.1581
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0018 0.0236 0.0236
Loa Loa (eye worm) TK/INSR protein kinase 0.0056 0.1418 0.1418
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0018 0.0236 0.0236
Onchocerca volvulus 0.0015 0.0157 0.0157
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.011 0.3107 0.3107
Entamoeba histolytica SH2-protein kinase domain containing protein 0.0011 0.0035 0.0009
Echinococcus multilocularis tyrosine protein kinase Blk 0.0015 0.0157 0.0157
Entamoeba histolytica serine/threonine protein kinase, putative 0.0247 0.7372 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0022 0.0358 0.0358
Trypanosoma cruzi polo-like protein kinase, putative 0.0247 0.7372 1
Echinococcus multilocularis insulin receptor 0.0056 0.1418 0.1418
Schistosoma mansoni cytochrome P450 reductase 0.0049 0.119 0.119
Plasmodium vivax NADPH-cytochrome p450 reductase, putative 0.0049 0.119 0.539
Brugia malayi Protein kinase domain containing protein 0.0116 0.3282 0.3282
Entamoeba histolytica protein kinase 2, putative 0.0074 0.1988 0.2667
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0018 0.0236 0.0236
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0056 0.1418 0.1418
Echinococcus multilocularis serine:threonine protein kinase N2 0.004 0.0913 0.0913
Trichomonas vaginalis AGC family protein kinase 0.004 0.0913 0.0921
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0012 0.0038 0.0038
Schistosoma mansoni retinoic acid receptor RXR 0.0022 0.0358 0.0358
Schistosoma mansoni tyrosine kinase 0.0152 0.4417 0.4417
Schistosoma mansoni tyrosine kinase 0.0089 0.2461 0.2461
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0056 0.1418 0.1418
Loa Loa (eye worm) inositol-1 0.0041 0.0952 0.0952
Brugia malayi protein-tyrosine kinase 0.0015 0.0157 0.0157
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.0952 0.1257
Echinococcus granulosus tyrosine protein kinase Src64B 0.0018 0.0236 0.0236
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0012 0.0038 0.0038
Giardia lamblia Kinase, PLK 0.0247 0.7372 1
Schistosoma mansoni tyrosine kinase 0.0082 0.2226 0.2226
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0026 0.0477 0.0477
Entamoeba histolytica PH domain containing protein kinase, putative 0.008 0.2163 0.2907
Echinococcus granulosus protein kinase c epsilon type 0.004 0.0913 0.0913
Brugia malayi p70 ribosomal S6 kinase beta 0.011 0.3107 0.3107
Trichomonas vaginalis serine/threonine-protein kinase sgk, putative 0.0036 0.0799 0.0761
Echinococcus granulosus histone acetyltransferase KAT2B 0.0145 0.4204 0.4204
Brugia malayi hypothetical protein 0.0028 0.0548 0.0548
Echinococcus granulosus death domain containing protein 0.0014 0.0121 0.0121
Loa Loa (eye worm) TK/FER protein kinase 0.0015 0.0157 0.0157
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0022 0.0358 0.0358
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0022 0.0358 0.0358
Brugia malayi FAD binding domain containing protein 0.0049 0.119 0.119
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0247 0.7372 0.7372
Loa Loa (eye worm) flavodoxin family protein 0.0019 0.0258 0.0258
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0179 0.5241 0.5241
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0044 0.1049 0.3314
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0022 0.0358 0.0358
Echinococcus multilocularis thyroid hormone receptor alpha 0.0022 0.0358 0.0358
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0022 0.0358 0.0358
Loa Loa (eye worm) hypothetical protein 0.0026 0.0477 0.0477
Giardia lamblia Hypothetical protein 0.0043 0.1018 0.013
Schistosoma mansoni thyroid hormone receptor 0.0022 0.0358 0.0358
Echinococcus multilocularis Protein kinase C, brain isozyme 0.004 0.0913 0.0913
Brugia malayi ecdysteroid receptor 0.0022 0.0358 0.0358
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0041 0.0952 0.0975
Echinococcus granulosus tyrosine kinase 0.0015 0.0157 0.0157
Echinococcus granulosus tyrosine protein kinase Srms 0.0015 0.0157 0.0157
Brugia malayi Uncoordinated protein 44 0.0014 0.0121 0.0121
Brugia malayi Protein kinase domain containing protein 0.0015 0.0157 0.0157
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0548 0.1686
Echinococcus granulosus tyrosine protein kinase Fyn 0.0018 0.0236 0.0236
Onchocerca volvulus 0.0015 0.0157 0.0157
Trichomonas vaginalis CAMK family protein kinase 0.01 0.2777 0.3541
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0041 0.0952 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0548 0.2649
Entamoeba histolytica type A flavoprotein, putative 0.0019 0.0258 0.0312
Loa Loa (eye worm) hypothetical protein 0.0013 0.0097 0.0097
Echinococcus granulosus tyrosine protein kinase Blk 0.0015 0.0157 0.0157
Echinococcus granulosus epidermal growth factor receptor 0.0089 0.2461 0.2461
Trichomonas vaginalis AGC family protein kinase 0.0116 0.3282 0.4252
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0086 0.235 0.235
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0018 0.0236 0.0236
Onchocerca volvulus 0.0022 0.0358 0.0358
Echinococcus granulosus Ankyrin 0.0014 0.0125 0.0125
Trichomonas vaginalis AGC family protein kinase 0.0116 0.3282 0.4252
Loa Loa (eye worm) hypothetical protein 0.0029 0.0574 0.0574
Brugia malayi Protein kinase domain containing protein 0.0056 0.1418 0.1418
Echinococcus multilocularis Immunoglobulin 0.0026 0.0477 0.0477
Echinococcus multilocularis ecdysone induced protein 78C 0.0022 0.0358 0.0358
Schistosoma mansoni tyrosine kinase 0.0089 0.2461 0.2461
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.004 0.0913 0.0913
Schistosoma mansoni serine/threonine-protein kinase 0.008 0.2163 0.2163
Leishmania major hypothetical protein, conserved 0.0019 0.0258 0.0312
Echinococcus granulosus methionine synthase reductase 0.003 0.0612 0.0612
Plasmodium falciparum nitric oxide synthase, putative 0.0049 0.119 0.5928
Entamoeba histolytica type A flavoprotein, putative 0.0019 0.0258 0.0312
Echinococcus multilocularis rac serine:threonine kinase 0.008 0.2163 0.2163
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0019 0.0258 0.0312
Loa Loa (eye worm) AGC/PKN protein kinase 0.004 0.0913 0.0913
Brugia malayi SH2 domain containing protein 0.0015 0.0157 0.0157
Echinococcus granulosus tyrosine protein kinase Lyn 0.0022 0.0349 0.0349
Schistosoma mansoni RAR-like nuclear receptor 0.0022 0.0358 0.0358
Echinococcus granulosus Serine:threonine protein kinase PLK4 0.0119 0.3366 0.3366
Schistosoma mansoni netrin receptor unc5 0.0017 0.0218 0.0218
Echinococcus granulosus tyrosine kinase 0.0015 0.0157 0.0157
Echinococcus granulosus activin receptor type 0.0011 0.0029 0.0029
Plasmodium vivax rac-beta serine/threonine protein kinase, putative 0.0074 0.1988 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0358 0.0358
Brugia malayi Immunoglobulin I-set domain containing protein 0.0026 0.0477 0.0477
Brugia malayi Variant SH3 domain containing protein 0.0013 0.0097 0.0097
Brugia malayi Death domain containing protein 0.0014 0.0121 0.0121
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0022 0.0358 0.0358
Loa Loa (eye worm) CAMK/PIM protein kinase 0.0332 1 1
Onchocerca volvulus Protein ultraspiracle homolog 0.0022 0.0358 0.0358
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.004 0.0913 0.0913
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0022 0.0358 0.0358
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0548 0.2649
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0022 0.0358 0.0358
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0024 0.0431 0.1306
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.004 0.0913 0.0913
Echinococcus granulosus Glutaredoxin protein 5 0.0071 0.1874 0.1874
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0071 0.1874 0.1874
Brugia malayi nuclear receptor RXR 0.0012 0.0038 0.0038
Trypanosoma cruzi rac serine-threonine kinase, putative 0.0074 0.1988 0.2667
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0022 0.0358 0.0358
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0044 0.1049 0.4573
Loa Loa (eye worm) TK/ABL protein kinase 0.0015 0.0157 0.0157
Entamoeba histolytica hypothetical protein 0.0024 0.0431 0.0548
Loa Loa (eye worm) TK/FER protein kinase 0.0015 0.0157 0.0157
Giardia lamblia Kinase, AGC PKA 0.0074 0.1988 0.1636
Echinococcus granulosus roundabout 2 0.0031 0.065 0.065
Brugia malayi hypothetical protein 0.0018 0.024 0.024
Echinococcus multilocularis tyrosine protein kinase shark 0.0015 0.0161 0.0161
Echinococcus multilocularis c src tyrosine kinase 0.0018 0.0236 0.0236
Leishmania major cytochrome P450 reductase, putative 0.0043 0.1018 0.1347
Echinococcus granulosus nuclear factor of activated T cells 5 0.0073 0.1939 0.1939
Echinococcus multilocularis protein kinase c iota type 0.004 0.0913 0.0913
Schistosoma mansoni nephrin 0.0028 0.0553 0.0553
Loa Loa (eye worm) hypothetical protein 0.0049 0.119 0.119
Schistosoma mansoni coup transcription factor 0.0022 0.0358 0.0358
Trypanosoma cruzi NADPH-dependent FMN/FAD containing oxidoreductase, putative 0.0049 0.119 0.1581
Echinococcus multilocularis inositol monophosphatase 1 0.0041 0.0952 0.0952
Echinococcus multilocularis epidermal growth factor receptor 0.0089 0.2461 0.2461
Onchocerca volvulus Serine\/threonine kinase homolog 0.0247 0.7372 0.7372
Echinococcus multilocularis tyrosine protein kinase Abl 0.0018 0.0236 0.0236
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0022 0.0358 0.0358
Trypanosoma cruzi p450 reductase, putative 0.0049 0.119 0.1581
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.004 0.0913 0.0913
Trichomonas vaginalis AGC family protein kinase 0.0116 0.3282 0.4252
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0155 0.4495 0.4495
Echinococcus multilocularis dual specificity testis specific protein kinase 0.0011 0.0029 0.0029
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0037 0.0818 1
Trypanosoma brucei NADPH-cytochrome p450 reductase, putative 0.0049 0.119 0.1581
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0247 0.7372 1
Brugia malayi flavodoxin family protein 0.0019 0.0258 0.0258
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0022 0.0358 0.0358
Loa Loa (eye worm) hypothetical protein 0.0022 0.0358 0.0358
Echinococcus granulosus insulin receptor 0.0056 0.1418 0.1418
Schistosoma mansoni serine/threonine kinase 0.004 0.0913 0.0913
Brugia malayi FAD binding domain containing protein 0.003 0.0612 0.0612
Echinococcus granulosus ecdysone induced protein 78C 0.0022 0.0358 0.0358
Loa Loa (eye worm) hypothetical protein 0.0031 0.065 0.065
Onchocerca volvulus 0.0143 0.4112 0.4112
Trichomonas vaginalis AGC family protein kinase 0.0116 0.3282 0.4252
Onchocerca volvulus Bile acid receptor homolog 0.0022 0.0358 0.0358
Loa Loa (eye worm) hypothetical protein 0.0028 0.0548 0.0548
Echinococcus granulosus nervana 2 0.0071 0.1874 0.1874
Echinococcus multilocularis tyrosine protein kinase Fps85D 0.0015 0.0157 0.0157
Entamoeba histolytica protein kinase, putative 0.0011 0.0035 0.0009
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0014 0.0125 0.0125
Trypanosoma cruzi Protein kinase B 0.008 0.2163 0.2907
Echinococcus multilocularis L aminoadipate semialdehyde 0.0086 0.235 0.235
Brugia malayi Nuclear hormone receptor-like 1 0.0012 0.0038 0.0038
Schistosoma mansoni tyrosine kinase 0.0056 0.1418 0.1418
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.004 0.0913 0.0913
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0014 0.0121 0.0121
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0018 0.0236 0.0236
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.0952 0.1257
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0089 0.2461 0.2461
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0018 0.0236 0.0236
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0041 0.0952 0.6859
Echinococcus multilocularis NADPH dependent diflavin oxidoreductase 1 0.0049 0.119 0.119
Brugia malayi steroid hormone receptor 0.0022 0.0358 0.0358
Brugia malayi nuclear hormone receptor 0.0022 0.0358 0.0358
Trypanosoma brucei polo-like protein kinase 0.0247 0.7372 1
Trichomonas vaginalis AGC family protein kinase 0.0045 0.1088 0.1168
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0022 0.0358 0.0358
Schistosoma mansoni kinase 0.0266 0.7961 0.7961
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0012 0.0038 0.0038
Entamoeba histolytica PH domain containing protein kinase, putative 0.008 0.2163 0.2907
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0022 0.0358 0.0358
Schistosoma mansoni serine/threonine protein kinase 0.0332 1 1
Schistosoma mansoni serine/threonine protein kinase 0.0247 0.7372 0.7372
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0022 0.0358 0.0358
Brugia malayi Protein kinase domain containing protein 0.0015 0.0157 0.0157
Leishmania major phosphopantetheinyl transferase-like protein 0.0024 0.0431 0.0548
Trichomonas vaginalis CAMK family protein kinase 0.0247 0.7372 1
Schistosoma mansoni tyrosine kinase 0.0018 0.0236 0.0236
Brugia malayi Protein kinase domain containing protein 0.0018 0.0234 0.0234
Trichomonas vaginalis CAMK family protein kinase 0.0247 0.7372 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0477 0.0477
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0018 0.0236 0.0236
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.015 0.4334 0.4334
Chlamydia trachomatis sulfite reductase 0.003 0.0612 1
Trichomonas vaginalis bromodomain-containing protein, putative 0.0044 0.1049 0.1112
Schistosoma mansoni vesicular amine transporter 0.0026 0.0477 0.0477
Echinococcus granulosus proto oncogene serine:threonine protein kinase 0.0332 1 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0022 0.0358 0.0358
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0022 0.0358 0.0358
Echinococcus granulosus c src tyrosine kinase 0.0018 0.0236 0.0236
Echinococcus granulosus tyrosine protein kinase Fyn 0.0018 0.0236 0.0236
Loa Loa (eye worm) TK/FER protein kinase 0.0015 0.0157 0.0157
Loa Loa (eye worm) TK/FER protein kinase 0.0015 0.0157 0.0157
Brugia malayi SH2 domain containing protein 0.0015 0.0157 0.0157
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0022 0.0358 0.0358
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0022 0.0358 0.0358
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0022 0.0358 0.0358
Schistosoma mansoni hypothetical protein 0.0014 0.0121 0.0121
Echinococcus multilocularis protein kinase c epsilon type 0.004 0.0913 0.0913
Loa Loa (eye worm) acetyltransferase 0.015 0.4334 0.4334
Echinococcus granulosus tyrosine protein kinase shark 0.0015 0.0161 0.0161
Echinococcus granulosus tyrosine protein kinase Fyn 0.0018 0.0236 0.0236
Leishmania major NADPH-cytochrome p450 reductase-like protein 0.0049 0.119 0.1581
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0013 0.0069 0.0069
Brugia malayi Nuclear hormone receptor-like 1 0.0022 0.0358 0.0358
Trypanosoma cruzi rac serine-threonine kinase, putative 0.008 0.2163 0.2907
Loa Loa (eye worm) hypothetical protein 0.0014 0.0125 0.0125
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.004 0.0913 0.0913
Entamoeba histolytica acetyltransferase, GNAT family 0.004 0.0935 0.1234
Echinococcus granulosus serine/threonine protein kinase 0.008 0.2163 0.2163
Trichomonas vaginalis AGC family protein kinase 0.0116 0.3282 0.4252
Trypanosoma cruzi NADPH--cytochrome P450 reductase, putative 0.0019 0.0258 0.0312
Mycobacterium ulcerans formate dehydrogenase H FdhF 0.0049 0.119 1
Toxoplasma gondii AGC kinase 0.011 0.3107 1
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.0548 0.0707
Loa Loa (eye worm) AGC/NDR protein kinase 0.004 0.0913 0.0913
Schistosoma mansoni thyroid hormone receptor 0.0022 0.0358 0.0358
Echinococcus granulosus netrin receptor unc 5 0.0017 0.0218 0.0218
Onchocerca volvulus 0.0015 0.0157 0.0157
Brugia malayi Immunoglobulin I-set domain containing protein 0.0179 0.5241 0.5241
Schistosoma mansoni atypical protein kinase C 0.004 0.0913 0.0913
Schistosoma mansoni 5-methyl tetrahydrofolate-homocysteine methyltransferase reductase 0.003 0.0612 0.0612
Trichomonas vaginalis CAMK family protein kinase 0.0247 0.7372 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0358 0.0358
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0022 0.0358 0.0358
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0041 0.0952 0.2998
Schistosoma mansoni serine/threonine protein kinase 0.004 0.0913 0.0913
Echinococcus multilocularis serine:threonine protein kinase N2 0.004 0.0913 0.0913
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0019 0.0258 0.0312
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0022 0.0358 0.0358
Schistosoma mansoni tyrosine kinase 0.0082 0.2226 0.2226
Loa Loa (eye worm) hypothetical protein 0.0022 0.0358 0.0358
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0018 0.0236 0.0236
Echinococcus multilocularis methionine synthase reductase 0.003 0.0612 0.0612
Trichomonas vaginalis AGC family protein kinase 0.0116 0.3282 0.4252
Loa Loa (eye worm) hypothetical protein 0.0012 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0026 0.0477 0.0477
Schistosoma mansoni serine/threonine protein kinase 0.0176 0.5152 0.5152
Echinococcus multilocularis Immunoglobulin 0.0026 0.0477 0.0477
Plasmodium falciparum S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0019 0.0258 0.1168
Echinococcus granulosus twitchin 0.0032 0.0667 0.0667
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0024 0.0431 0.1002
Schistosoma mansoni diflavin oxidoreductase 0.0024 0.0429 0.0429
Echinococcus multilocularis roundabout 2 0.0031 0.065 0.065
Loa Loa (eye worm) hypothetical protein 0.0012 0.0038 0.0038
Trichomonas vaginalis CAMK family protein kinase 0.01 0.2777 0.3541
Schistosoma mansoni protein kinase 0.0011 0.0029 0.0029
Brugia malayi acetyltransferase, GNAT family protein 0.015 0.4334 0.4334
Schistosoma mansoni tyrosine kinase 0.0018 0.0236 0.0236
Schistosoma mansoni tyrosine kinase 0.0161 0.4677 0.4677
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0022 0.0358 0.0358
Brugia malayi Furin-like cysteine rich region family protein 0.0161 0.4677 0.4677
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0049 0.119 0.1581
Loa Loa (eye worm) hypothetical protein 0.0014 0.0121 0.0121
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0015 0.0157 0.0157
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0022 0.0358 0.0358
Brugia malayi Protein kinase domain containing protein 0.0015 0.0157 0.0157
Loa Loa (eye worm) AGC/AKT protein kinase 0.0116 0.3282 0.3282
Brugia malayi Hr1 repeat family protein 0.004 0.0913 0.0913
Echinococcus granulosus protein kinase c iota type 0.004 0.0913 0.0913
Trichomonas vaginalis AGC family protein kinase 0.004 0.0913 0.0921
Echinococcus multilocularis 0.0048 0.1162 0.1162
Echinococcus multilocularis epidermal growth factor receptor 0.0161 0.4677 0.4677
Echinococcus granulosus NDR protein kinase 0.004 0.0913 0.0913
Echinococcus multilocularis Ankyrin 0.0014 0.0125 0.0125
Brugia malayi Protein kinase domain containing protein 0.004 0.0913 0.0913
Toxoplasma gondii flavodoxin domain-containing protein 0.0024 0.0429 0.1301
Echinococcus multilocularis nuclear factor of activated T cells 5 0.0073 0.1939 0.1939
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0012 0.0038 0.0038
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0022 0.0358 0.0358
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0022 0.0358 0.0358
Brugia malayi Protein kinase domain containing protein 0.0015 0.0157 0.0157
Echinococcus granulosus Protein kinase C brain isozyme 0.004 0.0913 0.0913
Echinococcus multilocularis proto oncogene serine:threonine protein kinase 0.0332 1 1
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0012 0.0038 0.0038
Brugia malayi hypothetical protein 0.0012 0.0038 0.0038
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0022 0.0358 0.0358
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0024 0.0431 0.1306
Echinococcus multilocularis nervana 2 0.0071 0.1874 0.1874
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0548 0.0707
Trichomonas vaginalis AGC family protein kinase 0.0116 0.3282 0.4252
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0044 0.1049 0.1112
Echinococcus granulosus serine:threonine protein kinase N2 0.004 0.0913 0.0913
Brugia malayi Protein kinase domain containing protein 0.0015 0.0157 0.0157
Schistosoma mansoni ankyrin 23/unc44 0.0014 0.0121 0.0121

Activities

Activity type Activity value Assay description Source Reference
IC50 (ADMET) = 20.47 umol/L Cytotoxicity against mouse L929 cells after 72 hrs by MTT assay ChEMBL. 22687745
IC50 (functional) > 100 umol/L Cytotoxicity against human DU145 cells after 72 hrs by MTT assay ChEMBL. 22687745

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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