Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Trypanosoma brucei | dihydrolipoamide dehydrogenase | 0.006 | 0.3229 | 0.4934 |
Trypanosoma cruzi | dihydrolipoamide dehydrogenase, putative | 0.006 | 0.3229 | 0.4934 |
Trypanosoma cruzi | dihydrolipoamide dehydrogenase, putative | 0.006 | 0.3229 | 0.4934 |
Echinococcus granulosus | survival motor neuron protein 1 | 0.0165 | 1 | 1 |
Toxoplasma gondii | NADPH-glutathione reductase | 0.006 | 0.3229 | 0.4934 |
Echinococcus multilocularis | thioredoxin glutathione reductase | 0.0104 | 0.6117 | 0.5948 |
Plasmodium vivax | glutathione reductase, putative | 0.0104 | 0.6117 | 1 |
Leishmania major | acetoin dehydrogenase e3 component-like protein | 0.006 | 0.3229 | 0.4934 |
Entamoeba histolytica | NAD(FAD)-dependent dehydrogenase, putative | 0.0016 | 0.0417 | 0.5 |
Echinococcus granulosus | guanine nucleotide binding protein Gs subunit | 0.0032 | 0.1451 | 0.1079 |
Trypanosoma brucei | dihydrolipoamide dehydrogenase, point mutation | 0.006 | 0.3229 | 0.4934 |
Plasmodium falciparum | glutathione reductase | 0.0104 | 0.6117 | 1 |
Trypanosoma brucei | dihydrolipoyl dehydrogenase | 0.006 | 0.3229 | 0.4934 |
Loa Loa (eye worm) | glutathione reductase | 0.0104 | 0.6117 | 0.6117 |
Brugia malayi | dihydrolipoyl dehydrogenase, mitochondrial precursor, putative | 0.006 | 0.3229 | 0.3229 |
Echinococcus multilocularis | lamin | 0.0017 | 0.0519 | 0.0106 |
Entamoeba histolytica | disulphide oxidoreductase, putative | 0.0016 | 0.0417 | 0.5 |
Trypanosoma brucei | trypanothione reductase | 0.0104 | 0.6117 | 1 |
Schistosoma mansoni | Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) | 0.0032 | 0.1451 | 0.1646 |
Entamoeba histolytica | thioredoxin reductase, putative | 0.0016 | 0.0417 | 0.5 |
Onchocerca volvulus | 0.0017 | 0.0519 | 0.0888 | |
Entamoeba histolytica | dihydropyrimidine dehydrogenase, putative | 0.0016 | 0.0417 | 0.5 |
Plasmodium falciparum | thioredoxin reductase | 0.006 | 0.3229 | 0.4934 |
Plasmodium vivax | dihydrolipoyl dehydrogenase, apicoplast, putative | 0.006 | 0.3229 | 0.4934 |
Echinococcus granulosus | lamin dm0 | 0.0017 | 0.0519 | 0.0106 |
Mycobacterium tuberculosis | Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras | 0.006 | 0.3229 | 0.4934 |
Mycobacterium tuberculosis | NADPH-dependent mycothiol reductase Mtr | 0.0104 | 0.6117 | 1 |
Brugia malayi | intermediate filament protein | 0.0017 | 0.0519 | 0.0519 |
Echinococcus granulosus | lamin | 0.0017 | 0.0519 | 0.0106 |
Mycobacterium tuberculosis | NAD(P)H quinone reductase LpdA | 0.006 | 0.3229 | 0.4934 |
Leishmania major | trypanothione reductase | 0.0104 | 0.6117 | 1 |
Trypanosoma cruzi | trypanothione reductase, putative | 0.0104 | 0.6117 | 1 |
Echinococcus granulosus | dihydrolipoamide dehydrogenase | 0.006 | 0.3229 | 0.2935 |
Schistosoma mansoni | survival motor neuron protein | 0.0034 | 0.1563 | 0.1824 |
Schistosoma mansoni | intermediate filament proteins | 0.0017 | 0.0519 | 0.0162 |
Brugia malayi | alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase | 0.0044 | 0.2213 | 0.2213 |
Trypanosoma cruzi | dihydrolipoyl dehydrogenase, putative | 0.006 | 0.3229 | 0.4934 |
Echinococcus multilocularis | dihydrolipoamide dehydrogenase | 0.006 | 0.3229 | 0.2935 |
Schistosoma mansoni | Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) | 0.0032 | 0.1451 | 0.1646 |
Loa Loa (eye worm) | intermediate filament tail domain-containing protein | 0.0017 | 0.0519 | 0.0519 |
Loa Loa (eye worm) | intermediate filament protein | 0.0017 | 0.0519 | 0.0519 |
Echinococcus granulosus | thioredoxin glutathione reductase | 0.0104 | 0.6117 | 0.5948 |
Loa Loa (eye worm) | hypothetical protein | 0.0165 | 1 | 1 |
Wolbachia endosymbiont of Brugia malayi | dihydrolipoamide dehydrogenase E3 component | 0.006 | 0.3229 | 1 |
Brugia malayi | glutamate synthase | 0.0016 | 0.0417 | 0.0417 |
Trypanosoma cruzi | dihydrolipoamide dehydrogenase, putative | 0.006 | 0.3229 | 0.4934 |
Echinococcus multilocularis | geminin | 0.0113 | 0.67 | 0.6556 |
Trypanosoma cruzi | dihydrolipoyl dehydrogenase, putative | 0.006 | 0.3229 | 0.4934 |
Echinococcus multilocularis | guanine nucleotide binding protein G(s) subunit | 0.0032 | 0.1451 | 0.1079 |
Echinococcus multilocularis | lamin dm0 | 0.0017 | 0.0519 | 0.0106 |
Loa Loa (eye worm) | pyridine nucleotide-disufhide oxidoreductase | 0.0016 | 0.0417 | 0.0417 |
Trypanosoma cruzi | dihydrolipoamide dehydrogenase, putative | 0.006 | 0.3229 | 0.4934 |
Brugia malayi | Pyridine nucleotide-disulphide oxidoreductase family protein | 0.0016 | 0.0417 | 0.0417 |
Mycobacterium tuberculosis | Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot | 0.006 | 0.3229 | 0.4934 |
Brugia malayi | GTP-binding regulatory protein Gs alpha-S chain, putative | 0.0032 | 0.1451 | 0.1451 |
Brugia malayi | Iron-sulfur cluster assembly accessory protein | 0.0034 | 0.1563 | 0.1563 |
Toxoplasma gondii | thioredoxin reductase | 0.0104 | 0.6117 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0034 | 0.1563 | 0.1824 |
Trypanosoma cruzi | dihydrolipoamide dehydrogenase, putative | 0.006 | 0.3229 | 0.4934 |
Mycobacterium ulcerans | dihydrolipoamide dehydrogenase, LpdB | 0.006 | 0.3229 | 1 |
Brugia malayi | Thioredoxin reductase | 0.0104 | 0.6117 | 0.6117 |
Loa Loa (eye worm) | programmed cell death 8 | 0.0016 | 0.0417 | 0.0417 |
Trichomonas vaginalis | glutathione reductase, putative | 0.006 | 0.3229 | 1 |
Schistosoma mansoni | dihydrolipoamide dehydrogenase | 0.006 | 0.3229 | 0.4476 |
Schistosoma mansoni | lamin | 0.0017 | 0.0519 | 0.0162 |
Trypanosoma cruzi | dihydrolipoamide dehydrogenase, putative | 0.006 | 0.3229 | 0.4934 |
Mycobacterium tuberculosis | Probable oxidoreductase | 0.006 | 0.3229 | 0.4934 |
Schistosoma mansoni | hypothetical protein | 0.0113 | 0.67 | 1 |
Mycobacterium ulcerans | dihydrolipoamide dehydrogenase | 0.006 | 0.3229 | 1 |
Plasmodium falciparum | dihydrolipoyl dehydrogenase, apicoplast | 0.006 | 0.3229 | 0.4934 |
Plasmodium falciparum | glutathione reductase | 0.006 | 0.3229 | 0.4934 |
Schistosoma mansoni | Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) | 0.0032 | 0.1451 | 0.1646 |
Plasmodium vivax | dihydrolipoyl dehydrogenase, mitochondrial, putative | 0.006 | 0.3229 | 0.4934 |
Plasmodium vivax | thioredoxin reductase, putative | 0.0104 | 0.6117 | 1 |
Echinococcus multilocularis | survival motor neuron protein 1 | 0.0165 | 1 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0016 | 0.0417 | 0.0417 |
Echinococcus granulosus | intermediate filament protein | 0.0017 | 0.0519 | 0.0106 |
Onchocerca volvulus | 0.0017 | 0.0519 | 0.0888 | |
Entamoeba histolytica | glutamate synthase beta subunit, putative | 0.0016 | 0.0417 | 0.5 |
Leishmania major | 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein | 0.006 | 0.3229 | 0.4934 |
Trichomonas vaginalis | mercuric reductase, putative | 0.006 | 0.3229 | 1 |
Schistosoma mansoni | lamin | 0.0017 | 0.0519 | 0.0162 |
Echinococcus multilocularis | musashi | 0.0017 | 0.0519 | 0.0106 |
Plasmodium falciparum | dihydrolipoyl dehydrogenase, mitochondrial | 0.006 | 0.3229 | 0.4934 |
Trypanosoma brucei | dihydrolipoamide dehydrogenase | 0.006 | 0.3229 | 0.4934 |
Brugia malayi | NADPH:adrenodoxin oxidoreductase, mitochondrial precursor | 0.0016 | 0.0417 | 0.0417 |
Leishmania major | dihydrolipoamide dehydrogenase, putative | 0.006 | 0.3229 | 0.4934 |
Plasmodium falciparum | thioredoxin reductase | 0.0104 | 0.6117 | 1 |
Entamoeba histolytica | glutamate synthase beta subunit, putative | 0.0016 | 0.0417 | 0.5 |
Schistosoma mansoni | hypothetical protein | 0.0113 | 0.67 | 1 |
Chlamydia trachomatis | dihydrolipoyl dehydrogenase | 0.006 | 0.3229 | 1 |
Onchocerca volvulus | 0.0034 | 0.1563 | 1 | |
Toxoplasma gondii | pyruvate dehydrogenase complex subunit PDH-E3II | 0.006 | 0.3229 | 0.4934 |
Treponema pallidum | NADH oxidase | 0.006 | 0.3229 | 1 |
Echinococcus multilocularis | guanine nucleotide binding protein G(s) subunit | 0.0032 | 0.1451 | 0.1079 |
Entamoeba histolytica | pyridine nucleotide-disulfide oxidoreductase family protein | 0.0016 | 0.0417 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0017 | 0.0519 | 0.0519 |
Brugia malayi | Pyridine nucleotide-disulphide oxidoreductase family protein | 0.0016 | 0.0417 | 0.0417 |
Mycobacterium leprae | DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE | 0.006 | 0.3229 | 1 |
Giardia lamblia | NADH oxidase lateral transfer candidate | 0.006 | 0.3229 | 1 |
Loa Loa (eye worm) | thioredoxin reductase | 0.0104 | 0.6117 | 0.6117 |
Loa Loa (eye worm) | GTP-binding regulatory protein Gs alpha-S chain | 0.0032 | 0.1451 | 0.1451 |
Brugia malayi | glutathione reductase | 0.0104 | 0.6117 | 0.6117 |
Echinococcus granulosus | geminin | 0.0113 | 0.67 | 0.6556 |
Mycobacterium ulcerans | flavoprotein disulfide reductase | 0.006 | 0.3229 | 1 |
Brugia malayi | Intermediate filament tail domain containing protein | 0.0017 | 0.0519 | 0.0519 |
Echinococcus granulosus | guanine nucleotide binding protein Gs subunit | 0.0032 | 0.1451 | 0.1079 |
Leishmania major | dihydrolipoamide dehydrogenase, putative | 0.006 | 0.3229 | 0.4934 |
Wolbachia endosymbiont of Brugia malayi | dihydrolipoamide dehydrogenase E3 component | 0.006 | 0.3229 | 1 |
Brugia malayi | Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein | 0.0044 | 0.2213 | 0.2213 |
Loa Loa (eye worm) | hypothetical protein | 0.0017 | 0.0499 | 0.0499 |
Trypanosoma cruzi | trypanothione reductase, putative | 0.006 | 0.3229 | 0.4934 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
CT50 (ADMET) | = 1200 ug ml-1 | Cytotoxicity against mouse L929 cells | ChEMBL. | 19010674 |
MBC (functional) | = 2 ug ml-1 | Antibacterial activity against Escherichia coli ATCC 25922 after 1 hr by CLSI M26-A based method at room temperature | ChEMBL. | 19362467 |
MBC (functional) | = 2 ug ml-1 | Bactericidal activity against Escherichia coli ATCC 25922 after 1 hr by CLSI M26-A method | ChEMBL. | 21570284 |
MBC (functional) | = 4 ug ml-1 | Antibacterial activity against Escherichia coli MCC 80392 after 16 to 20 hrs by CLSI standard method | ChEMBL. | 19010674 |
MFC (functional) | = 32 ug ml-1 | Antifungal activity against Candida albicans MCC 50319 after 16 to 20 hrs by CLSI standard method | ChEMBL. | 19010674 |
MFC (functional) | = 32 ug ml-1 | Antifungal activity against Candida albicans ATCC 10231 after 1 hr by CLSI M26-A based method at room temperature | ChEMBL. | 19362467 |
MFC (functional) | = 32 ug ml-1 | Fungicidal activity against Candida albicans ATCC 10231 after 1 hr by CLSI M26-A method | ChEMBL. | 21570284 |
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.