Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Echinococcus granulosus | acetylcholinesterase | 0.3004 | 0.5 | 0.5 |
Echinococcus multilocularis | acetylcholinesterase | 0.3004 | 0.5 | 0.5 |
Loa Loa (eye worm) | acetylcholinesterase 1 | 0.3004 | 0.5 | 0.5 |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | 0.3004 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.3004 | 0.5 | 0.5 |
Echinococcus multilocularis | carboxylesterase 5A | 0.3004 | 0.5 | 0.5 |
Brugia malayi | Carboxylesterase family protein | 0.3004 | 0.5 | 0.5 |
Echinococcus granulosus | carboxylesterase 5A | 0.3004 | 0.5 | 0.5 |
Echinococcus multilocularis | acetylcholinesterase | 0.3004 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.3004 | 0.5 | 0.5 |
Echinococcus granulosus | acetylcholinesterase | 0.3004 | 0.5 | 0.5 |
Loa Loa (eye worm) | carboxylesterase | 0.3004 | 0.5 | 0.5 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (functional) | = 22.1 uM | Cytotoxicity against human PC3 cells | ChEMBL. | 22123320 |
IC50 (functional) | = 50.4 uM | Cytotoxicity against human MIAPaCa2 cells | ChEMBL. | 22123320 |
IC50 (functional) | = 84.2 uM | Cytotoxicity against human DU145 cells | ChEMBL. | 22123320 |
IC50 (functional) | = 90.6 uM | Cytotoxicity against human MCF7 cells | ChEMBL. | 22123320 |
IC50 (functional) | > 100 uM | Cytotoxicity against human LNCAP cells | ChEMBL. | 22123320 |
IC50 (functional) | > 100 uM | Cytotoxicity against human MDA-MB-231 cells | ChEMBL. | 22123320 |
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.