Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 9/20 | 0.62 |
| ▸ | DRD4 | P21917 | 7/20 | 0.62 |
| ▸ | DRD3 | P35462 | 7/20 | 0.62 |
| ▸ | HTR1A | P08908 | 4/20 | 0.62 |
| ▸ | HTR2A | P28223 | 1/20 | 0.62 |
| ▸ | HTR7 | P34969 | 1/20 | 0.62 |
| ▸ | HTR2B | P41595 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | FLT1 | P17948 | 1/20 | 0.41 |
| ▸ | GCK | P35557 | 1/20 | 0.41 |
| ▸ | FLT4 | P35916 | 1/20 | 0.41 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.41 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.41 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30530574 | 0.91 | DRD2 (0.50) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL24499938 | 0.91 | DRD2 (0.50) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL29597108 | 0.80 | DRD2 (0.60) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL24499461 | 0.80 | DRD2 (0.60) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL24499909 | 0.80 | DRD2 (0.52) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL29597263 | 0.80 | DRD2 (0.52) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL29598378 | 0.80 | HDAC1 (0.45) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL24499948 | 0.80 | HDAC1 (0.45) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL24499915 | 0.78 | DRD2 (0.57) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL29597170 | 0.78 | DRD2 (0.57) | DRD2DRD4DRD3HTR1AHTR2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022117920-A1 | 2,3-DIHYDRO-4H-BENZO[B][1,4]OXAZIN-4-YL)(5-(PHENYL)-PYRIDIN-3-YL)METHANONE DERIVATIVES AND SIMILAR COMPOUNDS AS CYP11A1 INHIBITORS FOR THE TREATMENT OF PROSTATE CANCER | ORION CORPORATION (FI) | 2022-06-09 | — | — | WO | disclosed |