Detailed information for compound 1823062

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 456.402 | Formula: C22H20N2O9
  • H donors: 5 H acceptors: 9 LogP: -0.94 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC[C@H]([C@@H]([C@@H]([C@H](Cn1c2c3ccccc3C(=O)c2c2c(c1=O)cc(cc2)[N+](=O)[O-])O)O)O)O
  • InChi: 1S/C22H20N2O9/c25-9-16(27)21(30)20(29)15(26)8-23-18-12-3-1-2-4-13(12)19(28)17(18)11-6-5-10(24(32)33)7-14(11)22(23)31/h1-7,15-16,20-21,25-27,29-30H,8-9H2/t15-,16+,20+,21-/m0/s1
  • InChiKey: DUOLBKBRPQDGMB-HDIOYNLWSA-N  

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
Schistosoma mansoni tyrosine protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase ABL1 0.0264 0.0111 0.0111
Echinococcus granulosus lysine specific demethylase 5A 0.0112 0.0033 0.0033
Toxoplasma gondii Tyrosine kinase-like (TKL) protein 0.0264 0.0111 0.7663
Onchocerca volvulus 0.0264 0.0111 0.0351
Trichomonas vaginalis glucosylceramidase, putative 0.5249 0.2647 0.6803
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Mycobacterium tuberculosis Probable reductase 0.0108 0.0031 0.3564
Toxoplasma gondii PHD-finger domain-containing protein 0.0093 0.0023 0.1605
Schistosoma mansoni peptidase Clp (S14 family) 0.0331 0.0145 0.0145
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0217 0.0087 0.4893
Onchocerca volvulus 0.0264 0.0111 0.0351
Onchocerca volvulus 0.0264 0.0111 0.0351
Echinococcus multilocularis tyrosine protein kinase transmembrane receptor 0.0264 0.0111 0.0111
Trichomonas vaginalis glucosylceramidase, putative 0.7591 0.3839 1
Leishmania major protein kinase, putative 0.0264 0.0111 1
Echinococcus granulosus peregrin 0.0093 0.0023 0.0023
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) TKL/RAF/KSR protein kinase 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase Fes:Fps 0.0264 0.0111 0.0111
Echinococcus multilocularis jumonji domain containing protein 0.0129 0.0042 0.0042
Toxoplasma gondii protein kinase domain-containing protein 0.0264 0.0111 0.7663
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0264 0.0111 0.0111
Plasmodium falciparum protein kinase, putative 0.0264 0.0111 0.7663
Echinococcus multilocularis dual specificity testis specific protein kinase 0.0264 0.0111 0.0111
Giardia lamblia Protein 21.1 0.0264 0.0111 1
Echinococcus granulosus ephrin type A receptor 4 A 0.0264 0.0111 0.0111
Loa Loa (eye worm) transcription factor SMAD2 0.0119 0.0037 0.0037
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase Abl 0.0264 0.0111 0.0111
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0108 0.0031 0.3564
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/ABL protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) serine/threonine protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase HCK 0.0264 0.0111 0.0111
Echinococcus granulosus PHD finger protein rhinoceros 0.0093 0.0023 0.0023
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0331 0.0145 0.0145
Loa Loa (eye worm) MH2 domain-containing protein 0.0119 0.0037 0.0037
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Echinococcus granulosus kinase suppressor of Ras 1 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0264 0.0111 0.0111
Echinococcus granulosus dual specificity testis-specific protein kinase 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase Src64B 0.0264 0.0111 0.0111
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0108 0.0031 0.3564
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Onchocerca volvulus 0.0264 0.0111 0.0351
Loa Loa (eye worm) TK/KIN6 protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/DDR protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0264 0.0111 0.0111
Loa Loa (eye worm) jmjC domain-containing protein 0.0191 0.0074 0.0074
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0264 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Entamoeba histolytica hypothetical protein 0.0295 0.0126 1
Brugia malayi hypothetical protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Brugia malayi hypothetical protein 0.0264 0.0111 0.0111
Brugia malayi Receptor family ligand binding region containing protein 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) RGC/RGC protein kinase 0.0264 0.0111 0.0111
Onchocerca volvulus 0.0264 0.0111 0.0351
Schistosoma mansoni tyrosine-protein kinase fps85d 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni hypothetical protein 0.0093 0.0023 0.0023
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus granulosus protein tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis epidermal growth factor receptor 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Brugia malayi Adenylate and Guanylate cyclase catalytic domain containing protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/RYK protein kinase 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase csk 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK protein kinase 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0217 0.0087 1
Echinococcus multilocularis insulin receptor 0.0264 0.0111 0.0111
Echinococcus granulosus retinal guanylyl cyclase 2 0.0264 0.0111 0.0111
Trichomonas vaginalis glucosylceramidase, putative 0.7591 0.3839 1
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0331 0.0145 0.5
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0331 0.0145 0.5
Echinococcus multilocularis tyrosine protein kinase csk 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TKL/MLK/HH498 protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/CSK protein kinase 0.0264 0.0111 0.0111
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0331 0.0145 0.0145
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0264 0.0111 0.0111
Brugia malayi protein-tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0264 0.0111 0.0111
Plasmodium vivax tyrosine kinase-like protein, putative 0.0264 0.0111 0.7663
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) jmjC domain-containing protein 0.0112 0.0033 0.0033
Brugia malayi SH2 domain containing protein 0.0264 0.0111 0.0111
Echinococcus multilocularis retinal guanylyl cyclase 2 0.0264 0.0111 0.0111
Brugia malayi PHD-finger family protein 0.0093 0.0023 0.0023
Schistosoma mansoni protein tyrosine kinase 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0264 0.0111 0.0111
Onchocerca volvulus Atrial natriuretic peptide receptor 3 homolog 0.0264 0.0111 0.0351
Schistosoma mansoni protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Plasmodium falciparum phd finger protein, putative 0.0093 0.0023 0.1605
Loa Loa (eye worm) TK protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK protein kinase 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus granulosus peptidase Clp S14 family 0.0217 0.0087 0.0087
Echinococcus multilocularis tyrosine protein kinase shark 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/ROR protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0264 0.0111 0.0111
Brugia malayi Probable tyrosine-protein kinase kin-31 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) RGC/RGC protein kinase 0.0264 0.0111 0.0111
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0331 0.0145 1
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0331 0.0145 0.0145
Trypanosoma brucei AGC/RSK family serine/threonine kinase, putative 0.0264 0.0111 1
Trypanosoma brucei Flagellum attachment zone protein 20 0.0264 0.0111 1
Loa Loa (eye worm) TKL/STKR/TYPE1 protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase Blk 0.0264 0.0111 0.0111
Onchocerca volvulus 0.0264 0.0111 0.0351
Loa Loa (eye worm) hypothetical protein 0.0159 0.0057 0.0057
Echinococcus granulosus receptor type guanylyl cyclase 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis protein KINase family member (kin 25) 0.0264 0.0111 0.0111
Trichomonas vaginalis glucosylceramidase, putative 0.498 0.2511 0.6437
Echinococcus granulosus tyrosine kinase 0.0264 0.0111 0.0111
Schistosoma mansoni protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis activated cdc42 kinase 1 0.0264 0.0111 0.0111
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Onchocerca volvulus 0.0264 0.0111 0.0351
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Toxoplasma gondii hypothetical protein 0.0114 0.0034 0.2354
Onchocerca volvulus 0.0264 0.0111 0.0351
Echinococcus granulosus 3'partial|retinal guanylyl cyclase 2 0.0264 0.0111 0.0111
Onchocerca volvulus 0.0264 0.0111 0.0351
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis natriuretic peptide receptor 1 0.0264 0.0111 0.0111
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0093 0.0023 0.0023
Plasmodium vivax tyrosine kinase-like protein, putative 0.0264 0.0111 0.7663
Echinococcus granulosus tyrosine protein kinase Srms 0.0264 0.0111 0.0111
Entamoeba histolytica hypothetical protein 0.0295 0.0126 1
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0331 0.0145 1
Onchocerca volvulus 0.0264 0.0111 0.0351
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Onchocerca volvulus 0.0264 0.0111 0.0351
Trypanosoma cruzi protein kinase, putative 0.0264 0.0111 1
Echinococcus granulosus basic fibroblast growth factor receptor 1 A 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis peptidase Clp (S14 family) 0.0217 0.0087 0.0087
Toxoplasma gondii PHD-finger domain-containing protein 0.0093 0.0023 0.1605
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0331 0.0145 1
Loa Loa (eye worm) hypothetical protein 0.0093 0.0023 0.0023
Echinococcus multilocularis lysine specific demethylase 5A 0.0112 0.0033 0.0033
Echinococcus granulosus activated cdc42 kinase 1 0.0264 0.0111 0.0111
Echinococcus granulosus retinal guanylyl cyclase 2 0.0264 0.0111 0.0111
Echinococcus multilocularis raf serine:threonine protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0108 0.0031 0.3564
Plasmodium falciparum tyrosine kinase-like protein 0.0264 0.0111 0.7663
Onchocerca volvulus 0.0264 0.0111 0.0351
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.012 0.0037 0.0538
Echinococcus multilocularis ephrin type A receptor 4 A 0.0264 0.0111 0.0111
Plasmodium vivax hypothetical protein, conserved 0.0093 0.0023 0.1605
Echinococcus granulosus tyrosine protein kinase pr2 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase shark 0.0264 0.0111 0.0111
Echinococcus multilocularis kinase suppressor of Ras 1 0.0264 0.0111 0.0111
Trichomonas vaginalis glucosylceramidase, putative 0.7591 0.3839 1
Echinococcus granulosus protein kinase 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.7591 0.3839 0.3839
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Brugia malayi C-terminal src kinase protein 1 0.0264 0.0111 0.0111
Echinococcus multilocularis PHD finger protein rhinoceros 0.0093 0.0023 0.0023
Brugia malayi SH2 domain containing protein 0.0264 0.0111 0.0111
Echinococcus multilocularis alpha 1,6 mannosyl glycoprotein 1.9697 1 1
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0264 0.0111 0.0111
Echinococcus granulosus raf serine:threonine protein kinase 0.0264 0.0111 0.0111
Toxoplasma gondii Tyrosine kinase-like (TKL) protein 0.0264 0.0111 0.7663
Echinococcus granulosus epidermal growth factor receptor 0.0264 0.0111 0.0111
Brugia malayi Immunoglobulin I-set domain containing protein 0.0264 0.0111 0.0111
Schistosoma mansoni protein kinase 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0264 0.0111 0.0111
Echinococcus multilocularis peregrin 0.0093 0.0023 0.0023
Echinococcus granulosus epidermal growth factor receptor 0.0264 0.0111 0.0111
Brugia malayi jmjC domain containing protein 0.0304 0.0131 0.0131
Brugia malayi Raf kinase 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Schistosoma mansoni serine/threonine protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/ACK protein kinase 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase HCK 0.0264 0.0111 0.0111
Brugia malayi Tyrosine-protein kinase PR2 0.0264 0.0111 0.0111
Trichomonas vaginalis glucosylceramidase, putative 0.498 0.2511 0.6437
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase Blk 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase csk 0.0264 0.0111 0.0111
Trypanosoma brucei Pseudokinase, putative 0.0264 0.0111 1
Trichomonas vaginalis glucosylceramidase, putative 0.498 0.2511 0.6437
Loa Loa (eye worm) TK/EGFR protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis protein kinase 0.0264 0.0111 0.0111
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0331 0.0145 1
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Brugia malayi Furin-like cysteine rich region family protein 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Brugia malayi hypothetical protein 0.0264 0.0111 0.0111
Plasmodium falciparum tyrosine kinase-like protein 0.0264 0.0111 0.7663
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0331 0.0145 1
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/INSR protein kinase 0.0264 0.0111 0.0111
Plasmodium falciparum protein kinase, putative 0.0264 0.0111 0.7663
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0264 0.0111 1
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Leishmania major hypothetical protein, conserved 0.0264 0.0111 1
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0264 0.0111 0.0111
Echinococcus granulosus alpha 16 mannosyl glycoprotein 1.9697 1 1
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0264 0.0111 0.0111
Brugia malayi Probable ClpP-like protease 0.0331 0.0145 0.0145
Echinococcus granulosus natriuretic peptide receptor 1 0.0264 0.0111 0.0111
Mycobacterium tuberculosis Probable dehydrogenase 0.0108 0.0031 0.3564
Giardia lamblia Kinase, NEK 0.0264 0.0111 1
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.012 0.0037 0.4272
Trypanosoma brucei protein kinase, putative 0.0264 0.0111 1
Echinococcus granulosus tyrosine protein kinase Fps85D 0.0264 0.0111 0.0111
Brugia malayi Probable tyrosine-protein kinase kin-31 0.0264 0.0111 0.0111
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0264 0.0111 0.0111
Echinococcus granulosus fibroblast growth factor receptor 4 0.0264 0.0111 0.0111
Echinococcus multilocularis macrophage colony stimulating factor 1 receptor 0.0264 0.0111 0.0111
Schistosoma mansoni serine/threonine protein kinase 0.0264 0.0111 0.0111
Giardia lamblia Kinase, NEK 0.0264 0.0111 1
Echinococcus multilocularis tyrosine protein kinase Srms 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine protein kinase fes (fps) (ptk group IV) 0.0264 0.0111 0.0111
Echinococcus granulosus retinal guanylyl cyclase 2 0.0264 0.0111 0.0111
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.012 0.0037 0.4272
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Schistosoma mansoni hypothetical protein 0.0264 0.0111 0.0111
Echinococcus multilocularis activin receptor type 0.0264 0.0111 0.0111
Onchocerca volvulus 0.0264 0.0111 0.0351
Echinococcus granulosus tyrosine protein kinase Lyn 0.0264 0.0111 0.0111
Echinococcus granulosus atrial natriuretic peptide receptor 1 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase Fyn 0.0264 0.0111 0.0111
Trichomonas vaginalis glucosylceramidase, putative 0.7591 0.3839 1
Brugia malayi jmjC domain containing protein 0.0112 0.0033 0.0033
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0331 0.0145 0.5
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Entamoeba histolytica hypothetical protein 0.0295 0.0126 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0108 0.0031 0.3564
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0264 0.0111 0.0111
Loa Loa (eye worm) TKL/MLK/TAK1 protein kinase 0.0264 0.0111 0.0111
Brugia malayi proto-oncogene tyrosine-protein kinase FER 0.0264 0.0111 0.0111
Brugia malayi bone morphogenetic protein type 1 receptor 0.0264 0.0111 0.0111
Echinococcus granulosus mitogen-activated protein kinase kinase kinase 9 0.0264 0.0111 0.0111
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0114 0.0034 0.2354
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0114 0.0034 0.0283
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.7591 0.3839 0.3839
Echinococcus granulosus mitogen activated protein kinase kinase kinase 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase transmembrane receptor 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/EPH protein kinase 0.0264 0.0111 0.0111
Brugia malayi ephrin receptor 1 precursor 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase csk 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Brugia malayi Tyrosine-protein kinase abl-1 0.0264 0.0111 0.0111
Trichomonas vaginalis glucosylceramidase, putative 0.5249 0.2647 0.6803
Schistosoma mansoni jumonji/arid domain-containing protein 0.0112 0.0033 0.0033
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Leishmania major protein kinase, putative 0.0264 0.0111 1
Loa Loa (eye worm) TK protein kinase 0.0264 0.0111 0.0111
Brugia malayi Adenylate and Guanylate cyclase catalytic domain containing protein 0.0264 0.0111 0.0111
Toxoplasma gondii protein kinase 0.0264 0.0111 0.7663
Schistosoma mansoni serine/threonine protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 1.9697 1 1
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0264 0.0111 0.0111
Schistosoma mansoni jumonji/arid domain-containing protein 0.0112 0.0033 0.0033
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0264 0.0111 0.0111
Brugia malayi Bromodomain containing protein 0.0093 0.0023 0.0023
Echinococcus granulosus activated cdc42 kinase 1 0.0264 0.0111 0.0111
Echinococcus multilocularis protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase Fes:Fps 0.0264 0.0111 0.0111
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0264 0.0111 0.0111
Schistosoma mansoni ephrin receptor 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Onchocerca volvulus 0.0264 0.0111 0.0351
Echinococcus granulosus tyrosine protein kinase Fyn 0.0264 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Schistosoma mansoni protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni serine/threonine RGC 0.0264 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase ABL1 0.0264 0.0111 0.0111
Echinococcus multilocularis protein tyrosine kinase 0.0264 0.0111 0.0111
Giardia lamblia Kinase 0.0264 0.0111 1
Trichomonas vaginalis glucosylceramidase, putative 0.498 0.2511 0.6437
Loa Loa (eye worm) TK/FAK protein kinase 0.0264 0.0111 0.0111
Toxoplasma gondii calcium dependent protein kinase CDPK8 0.0264 0.0111 0.7663
Entamoeba histolytica protein kinase, putative 0.0295 0.0126 1
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Trichomonas vaginalis glucosylceramidase, putative 0.498 0.2511 0.6437
Echinococcus multilocularis retinal guanylyl cyclase 2 0.0264 0.0111 0.0111
Onchocerca volvulus Tyrosine kinase homolog 0.0264 0.0111 0.0351
Loa Loa (eye worm) TK/ALK protein kinase 0.0264 0.0111 0.0111
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0304 0.0131 0.0131
Loa Loa (eye worm) RGC/RGC protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Schistosoma mansoni protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase csk 0.0264 0.0111 0.0111
Onchocerca volvulus Tyrosine kinase receptor Cad96Ca homolog 0.0264 0.0111 0.0351
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0264 0.0111 0.0111
Brugia malayi Immunoglobulin I-set domain containing protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Onchocerca volvulus Glucosylceramidase homolog 0.498 0.2511 1
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Schistosoma mansoni protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis basic fibroblast growth factor receptor 1 A 0.0264 0.0111 0.0111
Schistosoma mansoni protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) PHD-finger family protein 0.0093 0.0023 0.0023
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine kinase 0.0264 0.0111 0.0111
Toxoplasma gondii STE kinase 0.0264 0.0111 0.7663
Echinococcus granulosus tyrosine protein kinase transmembrane receptor 0.0264 0.0111 0.0111
Loa Loa (eye worm) protein kinase domain-containing protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) SRC-1 0.0264 0.0111 0.0111
Mycobacterium tuberculosis Probable oxidoreductase 0.012 0.0037 0.4272
Brugia malayi integrin-linked kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis FL cytokine receptor 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis heat shock protein 70 0.0264 0.0111 0.0111
Brugia malayi Guanylyl cyclase protein 23 0.0264 0.0111 0.0111
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0304 0.0131 0.0131
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK protein kinase 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0331 0.0145 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.498 0.2511 0.6437
Loa Loa (eye worm) TK protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Schistosoma mansoni serine/threonine protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis integrin linked protein kinase 0.0264 0.0111 0.0111
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0114 0.0034 0.2354
Schistosoma mansoni ephrin receptor 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase csk 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis receptor type guanylyl cyclase 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase csk 0.0264 0.0111 0.0111
Loa Loa (eye worm) TKL/RAF/RAF protein kinase 0.0264 0.0111 0.0111
Trichomonas vaginalis glucosylceramidase, putative 0.7591 0.3839 1
Trichomonas vaginalis glucosylceramidase, putative 0.498 0.2511 0.6437
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni src-type protein tyrosine kinase-related 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus granulosus c src tyrosine kinase 0.0264 0.0111 0.0111
Plasmodium falciparum protein kinase, putative 0.0264 0.0111 0.7663
Echinococcus granulosus tyrosine protein kinase Fyn 0.0264 0.0111 0.0111
Plasmodium vivax protein kinase, putative 0.0264 0.0111 0.7663
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0331 0.0145 0.5
Echinococcus multilocularis tyrosine protein kinase Fps85D 0.0264 0.0111 0.0111
Onchocerca volvulus 0.0264 0.0111 0.0351
Brugia malayi Tyrosine-protein kinase F09A5.2 in chromosome X, putative 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine protein kinase fes (fps) (ptk group IV) 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine-protein kinase fps85d 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Schistosoma mansoni protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis retinal guanylyl cyclase 2 0.0264 0.0111 0.0111
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0264 0.0111 0.0111
Schistosoma mansoni jumonji domain containing protein 0.0241 0.0099 0.0099
Loa Loa (eye worm) TK/Met protein kinase 0.0264 0.0111 0.0111
Schistosoma mansoni beta-12-n-acetylglucosaminyltransferase II 1.9697 1 1
Echinococcus multilocularis tyrosine protein kinase 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) TKL/MLK/ILK protein kinase 0.0264 0.0111 0.0111
Brugia malayi MH2 domain containing protein 0.0119 0.0037 0.0037
Echinococcus multilocularis epidermal growth factor receptor 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) RGC/RGC protein kinase 0.0264 0.0111 0.0111
Echinococcus multilocularis c src tyrosine kinase 0.0264 0.0111 0.0111
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0217 0.0087 1
Schistosoma mansoni tyrosine kinase 0.0264 0.0111 0.0111
Loa Loa (eye worm) TK/FER protein kinase 0.0264 0.0111 0.0111
Echinococcus granulosus jumonji domain containing protein 0.0129 0.0042 0.0042
Echinococcus multilocularis atrial natriuretic peptide receptor 1 0.0264 0.0111 0.0111
Entamoeba histolytica leucine-rich repeat domain-containing protein 0.0295 0.0126 1
Trichomonas vaginalis glucosylceramidase, putative 0.7591 0.3839 1
Echinococcus granulosus tyrosine kinase 0.0264 0.0111 0.0111
Brugia malayi SRC-1 0.0264 0.0111 0.0111
Echinococcus granulosus tyrosine protein kinase Src42A 0.0264 0.0111 0.0111
Trypanosoma cruzi protein kinase, putative 0.0264 0.0111 1
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0264 0.0111 1
Echinococcus multilocularis fibroblast growth factor receptor 4 0.0264 0.0111 0.0111
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0331 0.0145 1
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Echinococcus granulosus insulin receptor 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase pr2 0.0264 0.0111 0.0111
Echinococcus granulosus macrophage colony stimulating factor 1 receptor 0.0264 0.0111 0.0111
Echinococcus granulosus integrin linked protein kinase 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Echinococcus granulosus activin receptor type 0.0264 0.0111 0.0111
Echinococcus multilocularis tyrosine protein kinase transmembrane receptor 0.0264 0.0111 0.0111
Brugia malayi Protein kinase domain containing protein 0.0264 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.0264 0.0111 0.0111
Trypanosoma brucei STE/STE11 serine/threonine-protein kinase, putative 0.0264 0.0111 1
Echinococcus multilocularis transfer RNA-Thr 0.0264 0.0111 0.0111

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) = 2.95 uM Growth inhibition of human MCF7 cells ChEMBL. 24517248
IC50 (binding) > 111 uM Inhibition of recombinant TDP1 (unknown origin) using N14Y as substrate after 15 mins by PAGE analysis ChEMBL. 24517248
Inhibition (binding) Inhibition of recombinant topoisomerase-1 (unknown origin) assessed as inhibition of 3'-[32P]-labeled DNA cleavage at 0.1 to 100 uM after 20 mins by PAGE analysis relative to control ChEMBL. 24517248

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

Bibliographic References

1 literature reference was collected for this gene.

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