| E3 UniProt | Gene / protein | Relation type | Ligand role | Direct | Functional | Docking | Source | Evidence |
|---|---|---|---|---|---|---|---|---|
| Q92831 | KAT2B;PCAF Histone acetyltransferase KAT2B |
reported_binder | bindingdb_reported | Yes | No | low | BindingDB:BDBM371526 | medium ; target=Histone acetyltransferase KAT2B |
| Source | Source ID | Source URL | Download URL | DOI / PMID |
|---|---|---|---|---|
| BindingDB | BDBM371526 | Open | - | 10.7270/Q2X06991 |
| Kind | Format | Status | Docking use | File / link | Preparation note |
|---|---|---|---|---|---|
| canonical_2d | SMILES | raw | Docking-ready | CN1[C@@H]2CC[C@H]1C[C@H](Nc1cnn(C)c(=O)c1Cl)C2 | keep_bindingdb_unique |
| generated_3d | SDF | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB016554/BDB016554.sdf | Generated from canonical SMILES |
| generated_3d | MOL2 | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB016554/BDB016554.mol2 | Generated from canonical SMILES |
| docking_ready | PDBQT | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB016554/BDB016554.pdbqt | Generated from canonical SMILES |
| image | PNG | prepared | Reference | public/e3_file/ligand_db/generated/BDB016554/BDB016554.png | Generated from canonical SMILES |
| image | SVG | prepared | Reference | public/e3_file/ligand_db/generated/BDB016554/BDB016554.svg | Generated from canonical SMILES |
| Target | Source | Assay | Result | Potency | Literature | Records |
|---|---|---|---|---|---|---|
|
Histone acetyltransferase KAT2B Q92831 E3 ligase component |
BindingDB:BDBM371526 | IC50 | 492 nM | Moderate | DOI: 10.7270/Q2X06991 | 1 |