Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | acetylcholinesterase (Yt blood group) | Starlite/ChEMBL | References |
Homo sapiens | butyrylcholinesterase | Starlite/ChEMBL | References |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Brugia malayi | Carboxylesterase family protein | butyrylcholinesterase | 602 aa | 546 aa | 30.2 % |
Brugia malayi | Carboxylesterase family protein | acetylcholinesterase (Yt blood group) | 614 aa | 510 aa | 26.5 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Trichomonas vaginalis | thymidine kinase, putative | 0.0244 | 1 | 0.5 |
Brugia malayi | Carboxylesterase family protein | 0.0164 | 0.2682 | 0.5 |
Trypanosoma cruzi | thymidine kinase, putative | 0.0244 | 1 | 0.5 |
Trypanosoma cruzi | thymidine kinase, putative | 0.0244 | 1 | 0.5 |
Leishmania major | thymidine kinase, putative | 0.0244 | 1 | 0.5 |
Echinococcus multilocularis | carboxylesterase 5A | 0.0164 | 0.2682 | 0.5 |
Trypanosoma brucei | thymidine kinase | 0.0244 | 1 | 1 |
Trichomonas vaginalis | thymidine kinase, putative | 0.0244 | 1 | 0.5 |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.2682 | 0.5 |
Giardia lamblia | Thymidine kinase | 0.0244 | 1 | 0.5 |
Echinococcus granulosus | carboxylesterase 5A | 0.0164 | 0.2682 | 0.5 |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.2682 | 0.5 |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | 0.0164 | 0.2682 | 1 |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.2682 | 0.5 |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.2682 | 0.5 |
Trichomonas vaginalis | thymidine kinase, putative | 0.0244 | 1 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.2682 | 0.5 |
Brugia malayi | Carboxylesterase family protein | 0.0164 | 0.2682 | 0.5 |
Loa Loa (eye worm) | acetylcholinesterase 1 | 0.0164 | 0.2682 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.2682 | 0.5 |
Loa Loa (eye worm) | carboxylesterase | 0.0164 | 0.2682 | 0.5 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (binding) | = 1.4 nM | In vitro inhibition of human erythrocyte Acetylcholinesterase. | ChEMBL. | 11689067 |
IC50 (binding) | = 1.4 nM | In vitro inhibition of human erythrocyte Acetylcholinesterase. | ChEMBL. | 11689067 |
IC50 (binding) | = 1.4 nM | Inhibition of AChE | ChEMBL. | 20053484 |
IC50 (binding) | = 13.9 nM | In vitro inhibition of human serum Butyrylcholinesterase. | ChEMBL. | 11689067 |
IC50 (binding) | = 13.9 nM | In vitro inhibition of human serum Butyrylcholinesterase. | ChEMBL. | 11689067 |
K3 (ADMET) | = 2.3 min-1 | Compound was evaluated for rate constant (K3) | ChEMBL. | 11689067 |
K5 (ADMET) | = 0.77 hr-1 | Compound was evaluated for rate constant (K5) | ChEMBL. | 11689067 |
Kc (ADMET) | = 6.4 nM | Compound was evaluated for equilibrium constant | ChEMBL. | 11689067 |
Ratio (binding) | = 9.9 | Ratio of IC50 against BuChE to that of AChE | ChEMBL. | 11689067 |
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.
2 literature references were collected for this gene.