| E3 UniProt | Gene / protein | Relation type | Ligand role | Direct | Functional | Docking | Source | Evidence |
|---|---|---|---|---|---|---|---|---|
| O75530 | EED Polycomb protein EED |
reported_binder | bindingdb_reported | Yes | No | low | BindingDB:BDBM291845 | medium ; target=Polycomb protein EED; Histone-lysine N-methyltransferase EZH2 |
| Kind | Format | Status | Docking use | File / link | Preparation note |
|---|---|---|---|---|---|
| canonical_2d | SMILES | raw | Docking-ready | Fc1ccc2c(c1CNc1ncc(-c3ccc(C(F)(F)F)nc3)c3nncn13)CCO2 | keep_bindingdb_unique |
| generated_3d | SDF | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB013162/BDB013162.sdf | Generated from canonical SMILES |
| generated_3d | MOL2 | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB013162/BDB013162.mol2 | Generated from canonical SMILES |
| docking_ready | PDBQT | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB013162/BDB013162.pdbqt | Generated from canonical SMILES |
| image | PNG | prepared | Reference | public/e3_file/ligand_db/generated/BDB013162/BDB013162.png | Generated from canonical SMILES |
| image | SVG | prepared | Reference | public/e3_file/ligand_db/generated/BDB013162/BDB013162.svg | Generated from canonical SMILES |
| Target | Source | Assay | Result | Potency | Literature | Records |
|---|---|---|---|---|---|---|
|
Histone-lysine N-methyltransferase EZH2 O75530 E3 ligase component |
BindingDB:BDBM291845 | IC50 | 11 nM | High | DOI: 10.7270/Q24T6MD7 | 1 |
|
Histone-lysine N-methyltransferase EZH2 O75530 E3 ligase component |
BindingDB:BDBM291845 | IC50 | 5.9 nM | Very high | DOI: 10.7270/Q24T6MD7 | 1 |
|
Polycomb protein EED O75530 E3 ligase component |
BindingDB:BDBM291845 | IC50 | 11 nM | High | DOI: 10.7270/Q29W0JNH | 1 |
|
Polycomb protein EED O75530 E3 ligase component |
BindingDB:BDBM291845 | IC50 | 5.9 nM | Very high | DOI: 10.7270/Q29W0JNH | 1 |