| Stem definition | Drug id | CAS RN |
|---|---|---|
| acetylcholinesterase inhibitors | 3186 | 25573-43-7 |
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| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Indigestion | indication | 162031009 |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 13.89 | acidic |
| pKa2 | 7.96 | Basic |
| pKa3 | 6.48 | Basic |
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| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Acetylcholinesterase | Enzyme | IC50 | 6.82 | CHEMBL | |||||
| Cholinesterase | Enzyme | IC50 | 7.92 | CHEMBL | |||||
| Acetylcholinesterase | Enzyme | IC50 | 5.76 | CHEMBL |
| ID | Source |
|---|---|
| D07914 | KEGG_DRUG |
| 5995-96-0 | SECONDARY_CAS_RN |
| C0637914 | UMLSCUI |
| CHEBI:4855 | CHEBI |
| CHEMBL123248 | ChEMBL_ID |
| 65719 | PUBCHEM_CID |
| C060406 | MESH_SUPPLEMENTAL_RECORD_UI |
| 5758 | INN_ID |
| LW9S78L4M8 | UNII |
| 005663 | NDDF |
| 005664 | NDDF |
| 768343004 | SNOMEDCT_US |
| CHEMBL539874 | ChEMBL_ID |
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