| E3 UniProt | Gene / protein | Relation type | Ligand role | Direct | Functional | Docking | Source | Evidence |
|---|---|---|---|---|---|---|---|---|
| Q13490 | BIRC2;API1;MIHB;RNF48 Baculoviral IAP repeat-containing protein 2 |
reported_binder | bindingdb_reported | Yes | No | low | BindingDB:BDBM783373 | medium ; target=Baculoviral IAP repeat-containing protein 2 |
| Source | Source ID | Source URL | Download URL | DOI / PMID |
|---|---|---|---|---|
| BindingDB | BDBM783373 | Open | - | 10.7270/Q2XK8MC8 |
| Kind | Format | Status | Docking use | File / link | Preparation note |
|---|---|---|---|---|---|
| canonical_2d | SMILES | raw | Reference | C[C@@H]1CN(CC(=O)N2CC(C)(C)c3[nH]c(=O)c(Oc4ccc(F)cc4)cc32)[C@@H](CN2CCO[C@H](C(=O)NCc3ccc(CNC(=O)[C@@H]4CN(C[C@H]5CN[C@H](C)CN5CC(=O)N5CC(C)(C)c6[nH]c(=O)c(Oc7ccc(F)cc7)cc65)CCO4)cc3)C2)CN1 | keep_bindingdb_unique |
| generated_3d | SDF | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB042370/BDB042370.sdf | Generated from canonical SMILES |
| generated_3d | MOL2 | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB042370/BDB042370.mol2 | Generated from canonical SMILES |
| docking_ready | PDBQT | prepared | Docking-ready | public/e3_file/ligand_db/generated/BDB042370/BDB042370.pdbqt | Generated from canonical SMILES |
| image | PNG | prepared | Reference | public/e3_file/ligand_db/generated/BDB042370/BDB042370.png | Generated from canonical SMILES |
| image | SVG | prepared | Reference | public/e3_file/ligand_db/generated/BDB042370/BDB042370.svg | Generated from canonical SMILES |
| Target | Source | Assay | Result | Potency | Literature | Records |
|---|---|---|---|---|---|---|
|
Baculoviral IAP repeat-containing protein 2 Q13490 E3 ligase component |
BindingDB:BDBM783373 | IC50 | 5.35 nM | Very high | DOI: 10.7270/Q2XK8MC8 | 1 |