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 |
---|---|---|---|---|
Loa Loa (eye worm) | carboxylesterase | 0.0164 | 0.5 | 0.5 |
Echinococcus multilocularis | carboxylesterase 5A | 0.0164 | 0.5 | 0.5 |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.5 | 0.5 |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | 0.0164 | 0.5 | 0.5 |
Brugia malayi | Carboxylesterase family protein | 0.0164 | 0.5 | 0.5 |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.5 | 0.5 |
Loa Loa (eye worm) | acetylcholinesterase 1 | 0.0164 | 0.5 | 0.5 |
Echinococcus granulosus | carboxylesterase 5A | 0.0164 | 0.5 | 0.5 |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.5 | 0.5 |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.5 | 0.5 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (binding) | = 5.08 | Inhibitory concentration against butyrylcholinesterase from human serum | ChEMBL. | 12620072 |
IC50 (binding) | = 6.17 | Inhibitory concentration against acetylcholinesterase from human erythrocytes | ChEMBL. | 12620072 |
Log IC50 (binding) | = 5.08 | Inhibitory concentration against butyrylcholinesterase from human serum | ChEMBL. | 12620072 |
Log IC50 (binding) | = 6.17 | Inhibitory concentration against acetylcholinesterase from human erythrocytes | ChEMBL. | 12620072 |
pAI50 (functional) | Ability to reverse the D-tubocurarine-induced neuromuscular blockade in guinea pig left atrium. | ChEMBL. | 12620072 | |
pAI50 (functional) | 0 | Ability to reverse the D-tubocurarine-induced neuromuscular blockade in guinea pig left atrium. | ChEMBL. | 12620072 |
pKa (ADMET) | 0 | Apparent dissociation constant of compound was evaluated; n.d. indicates not determined | ChEMBL. | 12620072 |
pKb (functional) | Antagonsitic potency of compound towards Muscarinic acetylcholine receptor M2 in guinea pig left atrium. | ChEMBL. | 12620072 | |
pKb (functional) | 0 | Antagonsitic potency of compound towards Muscarinic acetylcholine receptor M2 in guinea pig left atrium. | ChEMBL. | 12620072 |
Selectivity (binding) | = 12 | Selectivity towards acetylcholinesterase over butyrylcholinesterase | ChEMBL. | 12620072 |
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.
1 literature reference was collected for this gene.