Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Loa Loa (eye worm) | hypothetical protein | 0.0168 | 0.2342 | 1 |
Plasmodium vivax | vacuolar-type H+ pumping pyrophosphatase, putative | 0.0361 | 0.5372 | 0.5 |
Toxoplasma gondii | V-type H(+)-translocating pyrophosphatase VP1 | 0.0361 | 0.5372 | 1 |
Trypanosoma cruzi | vacuolar-type proton translocating pyrophosphatase 1 | 0.0361 | 0.5372 | 0.5372 |
Echinococcus multilocularis | Basic leucine zipper (bZIP) transcription | 0.0039 | 0.0309 | 0.132 |
Loa Loa (eye worm) | cytochrome P450 family protein | 0.0028 | 0.0148 | 0.0632 |
Entamoeba histolytica | hypothetical protein | 0.0039 | 0.0309 | 0.5 |
Loa Loa (eye worm) | cytochrome P450 family protein | 0.0028 | 0.0148 | 0.0632 |
Mycobacterium leprae | Conserved hypothetical protein | 0.0019 | 0 | 0.5 |
Trypanosoma cruzi | Vacuolar proton pyrophosphatase 1, putative | 0.0361 | 0.5372 | 0.5372 |
Trypanosoma cruzi | phytoene synthase, putative | 0.0168 | 0.2342 | 0.2342 |
Trypanosoma cruzi | Lanosterol 14-alpha demethylase | 0.0655 | 1 | 1 |
Plasmodium falciparum | V-type K+-independent H+-translocating inorganic pyrophosphatase | 0.0361 | 0.5372 | 0.5 |
Mycobacterium ulcerans | cytochrome P450 185A4 Cyp185A4 | 0.0028 | 0.0148 | 0.0148 |
Echinococcus multilocularis | Squalene phytoene synthase | 0.0168 | 0.2342 | 1 |
Brugia malayi | hypothetical protein | 0.0039 | 0.0309 | 1 |
Mycobacterium tuberculosis | Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) | 0.0655 | 1 | 1 |
Brugia malayi | Cytochrome P450 family protein | 0.0028 | 0.0148 | 0.4792 |
Mycobacterium ulcerans | cytochrome P450 51B1 Cyp51B1 | 0.0655 | 1 | 1 |
Leishmania major | squalene synthase, putative | 0.0539 | 0.8176 | 0.8176 |
Trypanosoma cruzi | squalene synthase, putative | 0.0539 | 0.8176 | 0.8176 |
Trypanosoma brucei | squalene synthase, putative | 0.0539 | 0.8176 | 0.8148 |
Trypanosoma cruzi | squalene synthase, putative | 0.0539 | 0.8176 | 0.8176 |
Trypanosoma brucei | Lanosterol 14-alpha demethylase | 0.0655 | 1 | 1 |
Loa Loa (eye worm) | CYP4Cod1 | 0.0028 | 0.0148 | 0.0632 |
Plasmodium vivax | V-type H(+)-translocating pyrophosphatase, putative | 0.0361 | 0.5372 | 0.5 |
Schistosoma mansoni | transcription factor LCR-F1 | 0.0039 | 0.0309 | 0.132 |
Onchocerca volvulus | NADH dehydrogenase (ubiquinone) complex I, assembly factor 6 homolog | 0.0168 | 0.2342 | 0.5 |
Echinococcus granulosus | Basic leucine zipper bZIP transcription | 0.0039 | 0.0309 | 0.132 |
Entamoeba histolytica | hypothetical protein | 0.0039 | 0.0309 | 0.5 |
Trypanosoma cruzi | cytochrome P450, putative | 0.0028 | 0.0148 | 0.0148 |
Leishmania major | hypothetical protein, conserved | 0.0168 | 0.2342 | 0.2342 |
Echinococcus granulosus | Squalene phytoene synthase | 0.0168 | 0.2342 | 1 |
Plasmodium falciparum | V-type H(+)-translocating pyrophosphatase, putative | 0.0361 | 0.5372 | 0.5 |
Mycobacterium leprae | putative cytochrome p450 | 0.0019 | 0 | 0.5 |
Mycobacterium tuberculosis | Probable phytoene synthase PhyA | 0.0168 | 0.2342 | 0.2342 |
Leishmania major | vacuolar-type proton translocating pyrophosphatase 1, putative | 0.0361 | 0.5372 | 0.5372 |
Entamoeba histolytica | hypothetical protein | 0.0039 | 0.0309 | 0.5 |
Trypanosoma brucei | Pyrophosphate-energized vacuolar membrane proton pump 2, putative | 0.0361 | 0.5372 | 0.5303 |
Entamoeba histolytica | hypothetical protein | 0.0039 | 0.0309 | 0.5 |
Schistosoma mansoni | hypothetical protein | 0.0039 | 0.0309 | 0.132 |
Trypanosoma cruzi | cytochrome P450, putative | 0.0028 | 0.0148 | 0.0148 |
Mycobacterium ulcerans | phytoene synthase, CrtB | 0.0168 | 0.2342 | 0.2342 |
Brugia malayi | Cytochrome P450 family protein | 0.0028 | 0.0148 | 0.4792 |
Leishmania major | cytochrome p450-like protein | 0.0028 | 0.0148 | 0.0148 |
Schistosoma mansoni | hypothetical protein | 0.0168 | 0.2342 | 1 |
Trypanosoma cruzi | Lanosterol 14-alpha demethylase | 0.0655 | 1 | 1 |
Trypanosoma brucei | Pyrophosphate-energized vacuolar membrane proton pump 1 | 0.0361 | 0.5372 | 0.5303 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
CC50 (ADMET) | = 33.86 uM | Cytotoxicity against human MT4 cells by MTT assay | ChEMBL. | 18242784 |
CC50 (ADMET) | = 36.26 uM | Cytotoxicity against human CEM cells by MTT assay | ChEMBL. | 18242784 |
Inhibition (binding) | = 100 % | Inhibition of HIV1 reverse transcriptase at 100 ug/ml after 1 hr by microtiter plate ELISA | ChEMBL. | 18242784 |
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.