| Stem definition | Drug id | CAS RN |
|---|---|---|
| 3066 | 63-25-2 |
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| Source | Code | Description |
|---|---|---|
| CHEBI has role | CHEBI:22153 | acaricides |
| CHEBI has role | CHEBI:33286 | agricultural chemicals |
| CHEBI has role | CHEBI:35219 | plant growth inhibitors |
| CHEBI has role | CHEBI:37733 | EC 3.1.1.8 inhibitor |
| CHEBI has role | CHEBI:38461 | carbamate insecticides |
| CHEBI has role | CHEBI:38462 | acetylcholinesterase inhibitors |
| MeSH PA | D018678 | Cholinergic Agents |
| MeSH PA | D002800 | Cholinesterase Inhibitors |
| MeSH PA | D004791 | Enzyme Inhibitors |
| MeSH PA | D007306 | Insecticides |
| MeSH PA | D018377 | Neurotransmitter Agents |
| MeSH PA | D010575 | Pesticides |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 13.74 | acidic |
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| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Acetylcholinesterase | Enzyme | IC50 | 5.51 | CHEMBL | |||||
| Acetylcholinesterase | Enzyme | IC50 | 5.21 | CHEMBL | |||||
| Ace-orthologous acetylcholinesterase; Acetylcholinesterase | Enzyme | IC50 | 7.54 | CHEMBL | |||||
| Acetylcholinesterase | Enzyme | IC50 | 6.70 | CHEMBL | |||||
| Acetylcholinesterase | Enzyme | IC50 | 7.32 | CHEMBL |
| ID | Source |
|---|---|
| N0000167377 | NUI |
| D07613 | KEGG_DRUG |
| C0036860 | UMLSCUI |
| CHEBI:3390 | CHEBI |
| CHEMBL46917 | ChEMBL_ID |
| DB15930 | DRUGBANK_ID |
| D012721 | MESH_DESCRIPTOR_UI |
| 6129 | PUBCHEM_CID |
| 9724 | RXNORM |
| 003720 | NDDF |
| 333035001 | SNOMEDCT_US |
| 9021002 | SNOMEDCT_US |
| 2858 | INN_ID |
| R890C8J3N1 | UNII |
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