| E3 UniProt | Gene / protein | Relation type | Ligand role | Direct | Functional | Docking | Source | Evidence |
|---|---|---|---|---|---|---|---|---|
| Q13191 | CBLB;RNF56;Nbla00127 E3 ubiquitin-protein ligase CBL-B |
reported_binder | bindingdb_reported | Yes | No | low | BindingDB:BDBM711132 | medium ; target=E3 ubiquitin-protein ligase CBL-B; Tyrosine-protein kinase Lck |
| Source | Source ID | Source URL | Download URL | DOI / PMID |
|---|---|---|---|---|
| BindingDB | BDBM711132 | Open | - | 10.7270/Q2G44VSH |
| Kind | Format | Status | Docking use | File / link | Preparation note |
|---|---|---|---|---|---|
| canonical_2d | SMILES | raw | Docking-ready | CO[C@H]1C[C@](c2cccc(N3Cc4c(cc(CNCCOC(F)F)cc4C(F)(F)F)C3=O)c2)(c2nncn2C)C1 | keep_bindingdb_unique |
| generated_3d | SDF | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB035835/BDB035835.sdf | Generated from canonical SMILES |
| generated_3d | MOL2 | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB035835/BDB035835.mol2 | Generated from canonical SMILES |
| docking_ready | PDBQT | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB035835/BDB035835.pdbqt | Generated from canonical SMILES |
| image | PNG | prepared | Reference | public/e3_file/ligand_db/generated/BDB035835/BDB035835.png | Generated from canonical SMILES |
| image | SVG | prepared | Reference | public/e3_file/ligand_db/generated/BDB035835/BDB035835.svg | Generated from canonical SMILES |
| Target | Source | Assay | Result | Potency | Literature | Records |
|---|---|---|---|---|---|---|
|
E3 ubiquitin-protein ligase CBL-B Q13191 E3 ligase component |
BindingDB:BDBM711132 | Kd | 2.9 nM | Very high | DOI: 10.7270/Q2G44VSH | 1 |
|
Tyrosine-protein kinase Lck Q13191 E3 ligase component |
BindingDB:BDBM711132 | IC50 | 8.4 nM | Very high | DOI: 10.7270/Q2G44VSH | 1 |