DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Acetylcholinesterase
Ligand Name
(2R)-2-[[4-fluoranyl-1-[(4-fluorophenyl)methyl]piperidin-4-yl]methyl]-5,6-dimethoxy-2,3-dihydroinden-1-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
AEHZLLUTPCJFHO-GOSISDBHSA-N
SMILES
COc1cc2c(cc1OC)C(=O)C(C2)CC3(CCN(CC3)Cc4ccc(cc4)F)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 7D9O
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse7d9oA1e7d9oB1
ECOD domains from experimental PDB structures interacting with ligand H0L
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P22303n/aH0L7d9oe7d9oA1A:4-542
P22303n/aH0L7d9oe7d9oB1B:4-542