| E3 UniProt | Gene / protein | Relation type | Ligand role | Direct | Functional | Docking | Source | Evidence |
|---|---|---|---|---|---|---|---|---|
| P35869 | AHR;BHLHE76 Aryl hydrocarbon receptor |
direct_binder | e3_ligand | Yes | Yes | medium | e3_ligand:43 | high AhR |
| Source | Source ID | Source URL | Download URL | DOI / PMID |
|---|---|---|---|---|
| e3_ligand | 43 | - | - |
| Kind | Format | Status | Docking use | File / link | Preparation note |
|---|---|---|---|---|---|
| canonical_2d | SMILES | raw | Docking-ready | O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12 | keep_base |
| generated_3d | SDF | prepared | Docking-ready | public/e3_file/ligand_db/generated/LIG001625/LIG001625.sdf | Generated from canonical SMILES |
| generated_3d | MOL2 | prepared | Docking-ready | public/e3_file/ligand_db/generated/LIG001625/LIG001625.mol2 | Generated from canonical SMILES |
| docking_ready | PDBQT | prepared | Docking-ready | public/e3_file/ligand_db/generated/LIG001625/LIG001625.pdbqt | Generated from canonical SMILES |
| image | PNG | prepared | Reference | public/e3_file/ligand_db/generated/LIG001625/LIG001625.png | Generated from canonical SMILES |
| image | SVG | prepared | Reference | public/e3_file/ligand_db/generated/LIG001625/LIG001625.svg | Generated from canonical SMILES |
| Target | Source | Assay | Result | Potency | Literature | Records |
|---|---|---|---|---|---|---|
| No standardized activity value is available in the imported source data for this compound. The E3 relation and literature/source evidence above are still retained for traceability. | ||||||