Detailed information for compound 421919

Basic information

Technical information
  • TDR Targets ID: 421919
  • Name: N-[2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dim ethylbutane-1,4-diamine
  • MW: 337.434 | Formula: C21H24FN3
  • H donors: 1 H acceptors: 1 LogP: 4.69 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN(CCCCNc1cc(nc2c1cccc2)c1ccccc1F)C
  • InChi: 1S/C21H24FN3/c1-25(2)14-8-7-13-23-20-15-21(16-9-3-5-11-18(16)22)24-19-12-6-4-10-17(19)20/h3-6,9-12,15H,7-8,13-14H2,1-2H3,(H,23,24)
  • InChiKey: PWHBOUQCLYPNIR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[2-(2-fluorophenyl)-4-quinolyl]-N',N'-dimethyl-butane-1,4-diamine
  • N-[2-(2-fluorophenyl)-4-quinolyl]-N',N'-dimethylbutane-1,4-diamine
  • N-[2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethyl-butane-1,4-diamine
  • 4-[[2-(2-fluorophenyl)-4-quinolyl]amino]butyl-dimethyl-amine
  • 4-dimethylaminobutyl-[2-(2-fluorophenyl)-4-quinolyl]amine

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
Trypanosoma cruzi rac serine-threonine kinase, putative 0.0126 0.6604 0.8095
Plasmodium falciparum cysteine proteinase falcipain 2a 0.002 0.0393 0.0392
Schistosoma mansoni hypothetical protein 0.0014 0.0028 0.0034
Brugia malayi Protein kinase domain containing protein 0.0059 0.2676 0.2676
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.0059 0.2676 0.326
Schistosoma mansoni serine/threonine protein kinase 0.0059 0.2676 0.3283
Giardia lamblia Kinase, AGC PKA 0.0115 0.5937 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.002 0.0393 0.0449
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0016 0.0128 0.0157
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0053 0.2305 1
Echinococcus granulosus serine/threonine protein kinase 0.0126 0.6604 0.8102
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.1118 0.1118
Plasmodium vivax vivapain-2 0.002 0.0393 0.0392
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.3731 0.3714
Echinococcus multilocularis cathepsin L cysteine protease 0.002 0.0393 0.0449
Treponema pallidum NADH oxidase 0.0053 0.2305 1
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0053 0.2305 0.2803
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.002 0.0393 0.0393
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0059 0.2676 0.326
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0053 0.2305 0.2447
Entamoeba histolytica cysteine proteinase, putative 0.002 0.0393 0.0393
Onchocerca volvulus 0.002 0.0393 0.3513
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0014 0.0028 0.0028
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0014 0.0028 0.0028
Loa Loa (eye worm) AGC/PKN protein kinase 0.0059 0.2676 0.2676
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.3731 0.3714
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0014 0.0028 0.0028
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.0059 0.2676 0.3283
Leishmania major cathepsin L-like protease 0.0077 0.3731 0.4559
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0053 0.2305 0.2443
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.002 0.0393 0.0393
Echinococcus granulosus glutamate synthase 0.0014 0.0028 0.0034
Echinococcus multilocularis serine threonine protein kinase 0.0059 0.2676 0.326
Echinococcus granulosus Glutaredoxin protein 5 0.0114 0.5863 0.7192
Brugia malayi p70 ribosomal S6 kinase beta 0.0173 0.9334 0.9334
Trichomonas vaginalis dihydrolipoamide dehydrogenase, putative 0.0014 0.0028 0.0028
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0053 0.2305 0.2284
Entamoeba histolytica pyridine nucleotide-disulfide oxidoreductase family protein 0.0014 0.0028 0.0028
Schistosoma mansoni serine/threonine-protein kinase 0.0126 0.6604 0.8102
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0053 0.2305 0.2803
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0053 0.2305 1
Echinococcus granulosus nervana 2 0.0114 0.5863 0.7192
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.002 0.0393 0.0393
Onchocerca volvulus Cathepsin L homolog 0.002 0.0393 0.3513
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0014 0.0028 0.0034
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.002 0.0393 0.0393
Mycobacterium tuberculosis Possible mycolic acid synthase UmaA 0.0163 0.877 1
Trichomonas vaginalis AGC family protein kinase 0.0184 1 1
Trypanosoma cruzi Protein kinase B 0.0126 0.6604 0.8095
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0173 0.9334 0.9334
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0053 0.2305 0.2443
Brugia malayi Cathepsin L-like precursor 0.002 0.0393 0.0393
Leishmania major trypanothione reductase 0.0153 0.8151 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Leishmania major cathepsin L-like protease 0.002 0.0393 0.0449
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.023 0.023
Loa Loa (eye worm) ctsf protein 0.002 0.0393 0.0393
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0053 0.2305 0.2828
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Onchocerca volvulus 0.002 0.0393 0.3513
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0114 0.5863 0.7183
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.002 0.0393 0.0393
Echinococcus granulosus protein kinase c iota type 0.0059 0.2676 0.3283
Echinococcus granulosus sulfide:quinone oxidoreductase 0.0014 0.0028 0.0034
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0053 0.2305 0.2605
Brugia malayi Cathepsin L-like precursor 0.002 0.0393 0.0393
Trichomonas vaginalis AGC family protein kinase 0.0059 0.2676 0.2676
Loa Loa (eye worm) fibroinase 0.002 0.0393 0.0393
Loa Loa (eye worm) thioredoxin reductase 0.0153 0.8151 0.8151
Echinococcus multilocularis nervana 2 0.0114 0.5863 0.7183
Echinococcus multilocularis lamin 0.0033 0.1118 0.1342
Echinococcus multilocularis nervana 2 0.0114 0.5863 0.7183
Schistosoma mansoni glutamate synthase 0.0014 0.0028 0.0034
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.3731 0.3714
Trichomonas vaginalis glutathione reductase, putative 0.0053 0.2305 0.2305
Echinococcus granulosus Protein kinase C brain isozyme 0.0059 0.2676 0.3283
Brugia malayi NADPH:adrenodoxin oxidoreductase, mitochondrial precursor 0.0014 0.0028 0.0028
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.002 0.0393 0.0393
Trichomonas vaginalis AGC family protein kinase 0.0059 0.2676 0.2676
Onchocerca volvulus Cathepsin F homolog 0.002 0.0393 0.3513
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0059 0.2676 0.2676
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0053 0.2305 0.2305
Onchocerca volvulus 0.002 0.0393 0.3513
Echinococcus multilocularis serine:threonine protein kinase N2 0.0059 0.2676 0.326
Schistosoma mansoni atypical protein kinase C 0.0059 0.2676 0.3283
Plasmodium falciparum glutathione reductase 0.0053 0.2305 0.2443
Leishmania major cathepsin L-like protease 0.002 0.0393 0.0449
Entamoeba histolytica glutamate synthase beta subunit, putative 0.0014 0.0028 0.0028
Trichomonas vaginalis dihydropyrimidine dehydrogenase, putative 0.0014 0.0028 0.0028
Entamoeba histolytica disulphide oxidoreductase, putative 0.0014 0.0028 0.0028
Schistosoma mansoni lamin 0.0033 0.1118 0.1372
Loa Loa (eye worm) hypothetical protein 0.0014 0.0028 0.0028
Loa Loa (eye worm) cysteine protease 0.002 0.0393 0.0393
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0053 0.2305 0.2605
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0053 0.2305 0.2605
Echinococcus granulosus serine:threonine protein kinase N2 0.0059 0.2676 0.3283
Trichomonas vaginalis AGC family protein kinase 0.0184 1 1
Trichomonas vaginalis AGC family protein kinase 0.0184 1 1
Echinococcus multilocularis serine threonine protein kinase nrc serine threonine protein kinase gad 0.0115 0.5937 0.7275
Schistosoma mansoni glutamate synthase 0.0014 0.0028 0.0034
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0016 0.0128 0.0124
Echinococcus multilocularis cysteine protease 0.002 0.0393 0.0449
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Leishmania major cathepsin L-like protease 0.002 0.0393 0.0449
Entamoeba histolytica PH domain containing protein kinase, putative 0.0126 0.6604 0.6604
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.3731 0.3714
Loa Loa (eye worm) AGC/NDR protein kinase 0.0059 0.2676 0.2676
Leishmania major cathepsin L-like protease 0.0077 0.3731 0.4559
Loa Loa (eye worm) programmed cell death 8 0.0014 0.0028 0.0028
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0014 0.0028 0.0028
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.3731 0.3714
Entamoeba histolytica PH domain containing protein kinase, putative 0.0126 0.6604 0.6604
Plasmodium falciparum phosphoethanolamine N-methyltransferase 0.0173 0.9349 1
Brugia malayi Papain family cysteine protease containing protein 0.002 0.0393 0.0393
Giardia lamblia NADH oxidase lateral transfer candidate 0.0053 0.2305 0.3854
Trichomonas vaginalis AGC family protein kinase 0.0059 0.2676 0.2676
Plasmodium vivax thioredoxin reductase, putative 0.0153 0.8151 0.8715
Schistosoma mansoni glutamate synthase 0.0014 0.0028 0.0034
Schistosoma mansoni serine/threonine protein kinase 0.0059 0.2676 0.3283
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0014 0.0028 0.0028
Onchocerca volvulus 0.002 0.0393 0.3513
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0053 0.2305 0.2284
Brugia malayi Cathepsin L-like precursor 0.002 0.0393 0.0393
Loa Loa (eye worm) hypothetical protein 0.0015 0.0093 0.0093
Echinococcus granulosus cathepsin l1 0.002 0.0393 0.0482
Brugia malayi Thioredoxin reductase 0.0153 0.8151 0.8151
Echinococcus multilocularis cathepsin L cysteine protease 0.002 0.0393 0.0449
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0071 0.3338 0.4075
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0014 0.0028 0.0028
Plasmodium vivax phosphoethanolamine N-methyltransferase 0.0173 0.9349 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Brugia malayi intermediate filament protein 0.0033 0.1118 0.1118
Echinococcus granulosus cathepsin L cysteine proteinase 0.002 0.0393 0.0482
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0053 0.2305 0.2803
Entamoeba histolytica protein kinase 2, putative 0.0115 0.5937 0.5937
Trypanosoma cruzi cruzipain precursor, putative 0.0077 0.3731 0.4559
Echinococcus granulosus protein kinase c epsilon type 0.0059 0.2676 0.3283
Loa Loa (eye worm) hypothetical protein 0.002 0.0393 0.0393
Plasmodium falciparum cysteine proteinase falcipain 2b 0.002 0.0393 0.0392
Echinococcus granulosus nervana 2 0.0114 0.5863 0.7192
Loa Loa (eye worm) AGC/AKT protein kinase 0.0184 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Mycobacterium ulcerans methyltransferase 0.0163 0.877 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Trichomonas vaginalis AGC family protein kinase 0.0184 1 1
Schistosoma mansoni cathepsin F (C01 family) 0.002 0.0393 0.0482
Loa Loa (eye worm) papain family cysteine protease containing protein 0.002 0.0393 0.0393
Schistosoma mansoni serine/threonine kinase 0.0059 0.2676 0.3283
Schistosoma mansoni disulfide oxidoreductase 0.0014 0.0028 0.0034
Entamoeba histolytica cysteine proteinase, putative 0.002 0.0393 0.0393
Plasmodium falciparum thioredoxin reductase 0.0053 0.2305 0.2443
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0053 0.2305 0.2803
Entamoeba histolytica dihydropyrimidine dehydrogenase, putative 0.0014 0.0028 0.0028
Echinococcus multilocularis protein kinase c epsilon type 0.0059 0.2676 0.326
Trichomonas vaginalis glutamate synthase, putative 0.0014 0.0028 0.0028
Schistosoma mansoni lamin 0.0033 0.1118 0.1372
Entamoeba histolytica glutamate synthase beta subunit, putative 0.0014 0.0028 0.0028
Brugia malayi Cathepsin L-like precursor 0.002 0.0393 0.0393
Entamoeba histolytica cysteine protease, putative 0.002 0.0393 0.0393
Mycobacterium ulcerans mycolic acid synthase UmaA 0.0163 0.877 1
Leishmania major cysteine peptidase A (CPA) 0.002 0.0393 0.0449
Echinococcus granulosus apoptosis inducing factor 1 mitochondrial 0.0014 0.0028 0.0034
Brugia malayi glutathione reductase 0.0153 0.8151 0.8151
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0053 0.2305 0.2803
Schistosoma mansoni serine/threonine protein kinase 0.0059 0.2676 0.3283
Echinococcus granulosus NDR protein kinase 0.0059 0.2676 0.3283
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.3731 0.3714
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0014 0.0028 0.0028
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.3731 0.3714
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0053 0.2305 0.2803
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0039 0.1482 0.1482
Brugia malayi glutamate synthase 0.0014 0.0028 0.0028
Brugia malayi Cathepsin L-like precursor 0.002 0.0393 0.0393
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.0059 0.2676 0.326
Plasmodium falciparum glutathione reductase 0.0153 0.8151 0.8715
Onchocerca volvulus 0.0033 0.1118 1
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.0059 0.2676 0.2676
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Schistosoma mansoni intermediate filament proteins 0.0033 0.1118 0.1372
Loa Loa (eye worm) glutathione reductase 0.0153 0.8151 0.8151
Onchocerca volvulus 0.0033 0.1118 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.002 0.0393 0.0449
Brugia malayi cytoplasmic intermediate filament protein 0.0017 0.023 0.023
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0014 0.0028 0.0034
Entamoeba histolytica protein kinase, putative 0.0184 1 1
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0053 0.2305 0.2803
Echinococcus multilocularis musashi 0.0033 0.1118 0.1342
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.1118 0.1118
Trypanosoma cruzi cysteine peptidase, putative 0.0077 0.3731 0.4559
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0053 0.2305 0.2443
Schistosoma mansoni serine/threonine protein kinase 0.0059 0.2676 0.3283
Loa Loa (eye worm) intermediate filament protein 0.0033 0.1118 0.1118
Loa Loa (eye worm) hypothetical protein 0.0033 0.1118 0.1118
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0053 0.2305 0.2803
Entamoeba histolytica NAD(FAD)-dependent dehydrogenase, putative 0.0014 0.0028 0.0028
Echinococcus granulosus lamin 0.0033 0.1118 0.1372
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0053 0.2305 0.2803
Brugia malayi Protein kinase domain containing protein 0.0059 0.2676 0.2676
Echinococcus granulosus thioredoxin glutathione reductase 0.0153 0.8151 1
Echinococcus granulosus NADPH:adrenodoxin oxidoreductase 0.0014 0.0028 0.0034
Trypanosoma cruzi major cysteine proteinase, putative 0.0061 0.2762 0.3366
Loa Loa (eye worm) hypothetical protein 0.0015 0.0093 0.0093
Leishmania major cathepsin L-like protease 0.0077 0.3731 0.4559
Schistosoma mansoni serine/threonine protein kinase 0.0059 0.2676 0.3283
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0014 0.0028 0.0028
Trypanosoma cruzi trypanothione reductase, putative 0.0053 0.2305 0.2803
Loa Loa (eye worm) pyridine nucleotide-disufhide oxidoreductase 0.0014 0.0028 0.0028
Trichomonas vaginalis AGC family protein kinase 0.0071 0.3342 0.3342
Schistosoma mansoni cathepsin F (C01 family) 0.002 0.0393 0.0482
Entamoeba histolytica protein kinase, putative 0.0059 0.2676 0.2676
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.002 0.0393 0.0393
Echinococcus multilocularis thioredoxin glutathione reductase 0.0153 0.8151 1
Trichomonas vaginalis serine/threonine-protein kinase sgk, putative 0.0058 0.2601 0.2601
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0153 0.8151 0.9292
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0053 0.2305 0.2605
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0053 0.2305 0.2284
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.002 0.0393 0.0393
Trichomonas vaginalis glutamate synthase, putative 0.0014 0.0028 0.0028
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0059 0.2676 0.2676
Echinococcus multilocularis serine:threonine protein kinase 38 0.0059 0.2676 0.326
Echinococcus multilocularis protein kinase c iota type 0.0059 0.2676 0.326
Plasmodium vivax rac-beta serine/threonine protein kinase, putative 0.0115 0.5937 0.634
Trypanosoma cruzi cysteine peptidase, putative 0.002 0.0393 0.0449
Trypanosoma cruzi cysteine peptidase, putative 0.0077 0.3731 0.4559
Echinococcus multilocularis cysteine protease 0.002 0.0393 0.0449
Trichomonas vaginalis AGC family protein kinase 0.0184 1 1
Leishmania major cathepsin L-like protease 0.002 0.0393 0.0449
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0053 0.2305 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.1083 0.1083
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0014 0.0028 0.0028
Toxoplasma gondii AGC kinase 0.0173 0.9334 1
Trypanosoma brucei trypanothione reductase 0.0153 0.8151 0.8146
Entamoeba histolytica protein kinase, putative 0.0184 1 1
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0053 0.2305 0.2443
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.3731 0.3714
Toxoplasma gondii cathepsin CPL 0.002 0.0393 0.0392
Trypanosoma cruzi trypanothione reductase, putative 0.0153 0.8151 1
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0053 0.2305 0.2828
Plasmodium vivax vivapain-2 0.002 0.0393 0.0392
Brugia malayi Cathepsin L-like precursor 0.002 0.0393 0.0393
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.002 0.0393 0.0393
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.0059 0.2676 0.326
Echinococcus granulosus protein kinase C gamma type 0.0059 0.2676 0.3283
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0053 0.2305 0.2284
Plasmodium falciparum thioredoxin reductase 0.0153 0.8151 0.8715
Plasmodium falciparum cysteine proteinase falcipain 3 0.002 0.0393 0.0392
Echinococcus granulosus pyridine nucleotide disulfide oxidoreductase 0.0014 0.0028 0.0034
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.0059 0.2676 0.3283
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0053 0.2305 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Schistosoma mansoni serine/threonine-protein kinase 0.0126 0.6604 0.8102
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0039 0.1482 0.1482
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.3731 0.3714
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.002 0.0393 0.0393
Entamoeba histolytica thioredoxin reductase, putative 0.0014 0.0028 0.0028
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0053 0.2305 0.2803
Trypanosoma cruzi cysteine peptidase, putative 0.0077 0.3731 0.4559
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0053 0.2305 0.2803
Echinococcus multilocularis lamin dm0 0.0033 0.1118 0.1342
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Trypanosoma cruzi rac serine-threonine kinase, putative 0.0115 0.5937 0.7275
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0014 0.0028 0.0028
Brugia malayi Hr1 repeat family protein 0.0059 0.2676 0.2676
Toxoplasma gondii thioredoxin reductase 0.0153 0.8151 0.873
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.002 0.0393 0.0393
Trichomonas vaginalis apoptosis inducing factor, putative 0.0014 0.0028 0.0028
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.0059 0.2676 0.3283
Onchocerca volvulus Cathepsin L homolog 0.002 0.0393 0.3513
Trichomonas vaginalis AGC family protein kinase 0.0184 1 1
Echinococcus multilocularis rac serine:threonine kinase 0.0126 0.6604 0.8095
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.3731 0.3714
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0059 0.2676 0.2676
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Schistosoma mansoni serine/threonine protein kinase 0.0059 0.2676 0.3283
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.3731 0.3714
Trypanosoma brucei rac serine-threonine kinase, putative 0.0184 1 1
Echinococcus granulosus lamin dm0 0.0033 0.1118 0.1372
Onchocerca volvulus 0.002 0.0393 0.3513
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0114 0.5863 0.7192
Mycobacterium tuberculosis Probable oxidoreductase 0.0053 0.2305 0.2605
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Schistosoma mansoni serine/threonine protein kinase 0.0059 0.2676 0.3283
Leishmania major cathepsin L-like protease 0.002 0.0393 0.0449
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.002 0.0393 0.0393
Plasmodium falciparum RAC-beta serine/threonine protein kinase 0.0115 0.5937 0.634
Brugia malayi protein kinase C II. 0.0059 0.2676 0.2676
Onchocerca volvulus 0.002 0.0393 0.3513
Echinococcus granulosus serine threonine protein kinase nrc 0.0115 0.5937 0.7284
Plasmodium vivax glutathione reductase, putative 0.0153 0.8151 0.8715
Schistosoma mansoni sulfide quinone reductase 0.0014 0.0028 0.0034
Toxoplasma gondii NADPH-glutathione reductase 0.0053 0.2305 0.2447
Echinococcus multilocularis serine:threonine protein kinase N2 0.0059 0.2676 0.326
Schistosoma mansoni sulfide quinone reductase 0.0014 0.0028 0.0034
Trichomonas vaginalis mercuric reductase, putative 0.0053 0.2305 0.2305
Onchocerca volvulus 0.002 0.0393 0.3513
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0053 0.2305 0.2803
Entamoeba histolytica protein kinase, putative 0.0173 0.9334 0.9334
Loa Loa (eye worm) hypothetical protein 0.0059 0.2676 0.2676
Echinococcus granulosus intermediate filament protein 0.0033 0.1118 0.1372
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.002 0.0393 0.0393
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0053 0.2305 0.2605
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0053 0.2305 0.2605
Onchocerca volvulus 0.0014 0.0028 0.0247
Echinococcus granulosus calcium:calmodulin dependent protein kinase 0.0115 0.5937 0.7284
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0053 0.2305 0.2803
Echinococcus granulosus cathepsin l cysteine peptidase 0.002 0.0393 0.0482
Mycobacterium tuberculosis Possible methyltransferase (methylase) 0.0163 0.877 1
Trichomonas vaginalis AGC family protein kinase 0.0184 1 1
Echinococcus multilocularis Glutaredoxin protein 5 0.0114 0.5863 0.7183
Loa Loa (eye worm) hypothetical protein 0.0016 0.0128 0.0128

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = -6.97 Inhibition of CpG-oligodeoxynucleotides-induced immunostimulation in mouse WEHI 231 cells ChEMBL. 17049254
Log EC50 (functional) = 6.97 Inhibition of CpG-oligodeoxynucleotides-induced immunostimulation in mouse WEHI 231 cells ChEMBL. 17049254

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Mus musculus ChEMBL23 17049254

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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