Attributes
UniProt ID
Protein Name
Histone-lysine N-methyltransferase EZH2
Ligand Name
5,8-dichloro-2-[(4-ethyl-6-methyl-2-oxo-1,2-dihydropyridin-3-yl)methyl]-7-({1-[(2R)-2-hydroxypropanoyl]piperidin-4-yl}oxy)-3,4-dihydroisoquinolin-1(2H)-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
KBXFBLWYHFRQAH-OAHLLOKOSA-N
SMILES
CCC1=C(C(=O)NC(=C1)C)CN2CCc3c(cc(c(c3C2=O)Cl)OC4CCN(CC4)C(=O)C(C)O)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 5IJ7
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Color Legend
Unassigned regionsLigand / hetero atomse5ij7A1e5ij7A2e5ij7A3e5ij7A4e5ij7A6e5ij7A7e5ij7A8e5ij7B1e5ij7B2e5ij7B3e5ij7B4e5ij7B5e5ij7B6e5ij7B7e5ij7E1e5ij7F1e5ij7S1e5ij7T1
ECOD domains from experimental PDB structures interacting with ligand 6BN
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| G1KPH4 | n/a | 6BN | 5ij7 | e5ij7A1 | A:9-124 |
| G1KPH4 | n/a | 6BN | 5ij7 | e5ij7A2 | A:606-733 |
| G1KPH4 | n/a | 6BN | 5ij7 | e5ij7B1 | B:606-733 |
| G1KPH4 | n/a | 6BN | 5ij7 | e5ij7B2 | B:9-124 |
| G1KPH4 | n/a | 6BN | 5ij8 | e5ij8A1 | A:606-733 |
| G1KPH4 | n/a | 6BN | 5ij8 | e5ij8A7 | A:9-124 |
| G1KPH4 | n/a | 6BN | 5ij8 | e5ij8B3 | B:9-124 |
| G1KPH4 | n/a | 6BN | 5ij8 | e5ij8B7 | B:606-733 |