Attributes
UniProt ID
Protein Name
Acetylcholine-binding protein
Ligand Name
4-(4-methylpiperidin-1-yl)-6-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
YZEUYKXNCFTYAI-UHFFFAOYSA-N
SMILES
CC1CCN(CC1)c2cc(nc(n2)N)c3ccc(cc3)C(F)(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: 4QAC
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 atomse4qacA1e4qacB1e4qacC1e4qacD1e4qacE1e4qacF1e4qacG1e4qacH1e4qacI1e4qacJ1
ECOD domains from experimental PDB structures interacting with ligand KK3
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P58154 | n/a | KK3 | 4qac | e4qacA1 | A:-7-205 |
| P58154 | n/a | KK3 | 4qac | e4qacB1 | B:-1-205 |
| P58154 | n/a | KK3 | 4qac | e4qacC1 | C:-7-205 |
| P58154 | n/a | KK3 | 4qac | e4qacD1 | D:-7-209 |
| P58154 | n/a | KK3 | 4qac | e4qacE1 | E:-6-205 |
| P58154 | n/a | KK3 | 4qac | e4qacF1 | F:-7-205 |
| P58154 | n/a | KK3 | 4qac | e4qacG1 | G:-7-205 |
| P58154 | n/a | KK3 | 4qac | e4qacH1 | H:-7-205 |
| P58154 | n/a | KK3 | 4qac | e4qacI1 | I:-7-205 |
| P58154 | n/a | KK3 | 4qac | e4qacJ1 | J:-4-205 |