Attributes
UniProt ID
Protein Name
Toll-like receptor 8
Ligand Name
5-(4-azanylbutyl)-3-pentyl-quinolin-2-amine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
GHXJTPWIBLPAON-UHFFFAOYSA-N
SMILES
CCCCCc1cc2c(cccc2nc1N)CCCCN
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5AWC
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Color Legend
Unassigned regionsLigand / hetero atomse5awcA1e5awcA2e5awcB1e5awcB2e5awcC1e5awcC2e5awcD1e5awcD2
ECOD domains from experimental PDB structures interacting with ligand M4D
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q9NR97 | n/a | M4D | 5awc | e5awcA1 | A:31-433 |
| Q9NR97 | n/a | M4D | 5awc | e5awcA2 | A:459-818 |
| Q9NR97 | n/a | M4D | 5awc | e5awcB1 | B:31-432 |
| Q9NR97 | n/a | M4D | 5awc | e5awcB2 | B:458-817 |
| Q9NR97 | n/a | M4D | 5awc | e5awcC1 | C:31-432 |
| Q9NR97 | n/a | M4D | 5awc | e5awcC2 | C:458-731,C:738-817 |
| Q9NR97 | n/a | M4D | 5awc | e5awcD1 | D:33-38,D:46-432 |
| Q9NR97 | n/a | M4D | 5awc | e5awcD2 | D:460-815 |