Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Ustilago maydis (strain 521 / FGSC 9021) (Corn smut fungus) | Lanosterol 14-alpha demethylase | Starlite/ChEMBL | References |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Dictyostelium discoideum | cytochrome P450 family protein | Lanosterol 14-alpha demethylase | 561 aa | 539 aa | 20.2 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Schistosoma mansoni | hypothetical protein | 0.1107 | 1 | 1 |
Trichomonas vaginalis | WD repeat domain, putative | 0.1107 | 1 | 0.5 |
Mycobacterium tuberculosis | Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) | 0.0183 | 0.1364 | 1 |
Plasmodium vivax | isocitrate dehydrogenase [NADP], mitochondrial, putative | 0.0132 | 0.0889 | 0.5 |
Echinococcus multilocularis | protein will die slowly | 0.1107 | 1 | 1 |
Trypanosoma brucei | Lanosterol 14-alpha demethylase | 0.0183 | 0.1364 | 1 |
Echinococcus multilocularis | isocitrate dehydrogenase 2 (NADP+) | 0.0132 | 0.0889 | 0.0889 |
Echinococcus multilocularis | NADP dependent isocitrate dehydrogenase | 0.0132 | 0.0889 | 0.0889 |
Mycobacterium ulcerans | cytochrome P450 51B1 Cyp51B1 | 0.0183 | 0.1364 | 0.5 |
Echinococcus multilocularis | NADP dependent isocitrate dehydrogenase | 0.0132 | 0.0889 | 0.0889 |
Echinococcus multilocularis | NADP dependent isocitrate dehydrogenase | 0.0132 | 0.0889 | 0.0889 |
Trypanosoma cruzi | Lanosterol 14-alpha demethylase | 0.0183 | 0.1364 | 1 |
Toxoplasma gondii | isocitrate dehydrogenase | 0.0132 | 0.0889 | 0.5 |
Echinococcus granulosus | protein will die slowly | 0.1107 | 1 | 1 |
Toxoplasma gondii | isocitrate dehydrogenase | 0.0132 | 0.0889 | 0.5 |
Leishmania major | lanosterol 14-alpha-demethylase, putative | 0.0183 | 0.1364 | 1 |
Echinococcus multilocularis | isocitrate dehydrogenase | 0.0132 | 0.0889 | 0.0889 |
Plasmodium falciparum | isocitrate dehydrogenase [NADP], mitochondrial | 0.0132 | 0.0889 | 0.5 |
Trypanosoma cruzi | Lanosterol 14-alpha demethylase | 0.0183 | 0.1364 | 1 |
Onchocerca volvulus | 0.1107 | 1 | 0.5 | |
Leishmania major | isocitrate dehydrogenase [NADP], mitochondrial precursor, putative | 0.0132 | 0.0889 | 0.6513 |
Echinococcus granulosus | NADP dependent isocitrate dehydrogenase | 0.0132 | 0.0889 | 0.0889 |
Loa Loa (eye worm) | WD40 repeat protein | 0.1107 | 1 | 1 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Activity (binding) | = 5.1 % | Inhibition of 14alpha-demethylase Ustilago maydis ATCC 14826 assessed as reduction in ergosterol at 20 mg/ml (Rvb = 61%) | ChEMBL. | 10888582 |
Activity (binding) | = 8.8 % | Inhibition of 14alpha-demethylase Ustilago maydis ATCC 14826 assessed as reduction in 14alpha-methylfecosterol at 20 mg/ml (Rvb = 0.4%) | ChEMBL. | 10888582 |
Activity (binding) | = 20.6 % | Inhibition of 14alpha-demethylase Ustilago maydis ATCC 14826 assessed as reduction in obtusifoliol at 20 mg/ml (Rvb = 0.7%) | ChEMBL. | 10888582 |
Activity (binding) | = 61.1 % | Inhibition of 14alpha-demethylase Ustilago maydis ATCC 14826 assessed as reduction in eburicol at 20 mg/ml (Rvb = 3.4%) | ChEMBL. | 10888582 |
IC50 (binding) | = 0.54 mg/L | Inhibition of 14alpha-demethylase Ustilago maydis ATCC 14826 assessed as reduction in 14alpha-methylfecosterol | ChEMBL. | 10888582 |
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.