Attributes
UniProt ID
Protein Name
Epidermal growth factor receptor
Ligand Name
1-[(3R)-3-[4-azanyl-3-[3-chloranyl-4-[(6-methylpyridin-2-yl)methoxy]phenyl]pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
IQSSEXXITFEXLL-LJQANCHMSA-N
SMILES
Cc1cccc(n1)COc2ccc(cc2Cl)c3c4c(ncnc4n(n3)C5CCCN(C5)C(=O)C=C)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5GTY
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Color Legend
Unassigned regionsLigand / hetero atomse5gtyA1e5gtyB1e5gtyC1e5gtyD1e5gtyE1e5gtyF1e5gtyG1e5gtyH1
ECOD domains from experimental PDB structures interacting with ligand 816
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P00533 | n/a | 816 | 5gty | e5gtyA1 | A:700-1014 |
| P00533 | n/a | 816 | 5gty | e5gtyB1 | B:700-1014 |
| P00533 | n/a | 816 | 5gty | e5gtyC1 | C:700-1013 |
| P00533 | n/a | 816 | 5gty | e5gtyD1 | D:701-1014 |
| P00533 | n/a | 816 | 5gty | e5gtyE1 | E:701-1014 |
| P00533 | n/a | 816 | 5gty | e5gtyF1 | F:700-1013 |
| P00533 | n/a | 816 | 5gty | e5gtyG1 | G:699-1014 |
| P00533 | n/a | 816 | 5gty | e5gtyH1 | H:700-1016 |