Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.45 |
| ▸ | DRD2 | P14416 | 6/20 | 0.45 |
| ▸ | DRD3 | P35462 | 6/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.38 |
| ▸ | GNRHR | P30968 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5251170 | 0.97 | DRD2 (0.47) | HRH3DRD2DRD3AURKAAURKB | |
| SCHEMBL5250582 | 0.91 | DRD2 (0.45) | HRH3DRD2DRD3AURKAAURKB | |
| SCHEMBL5251237 | 0.88 | GNRHR (0.44) | HRH3DRD2DRD3HTR2AGNRHR | |
| SCHEMBL5072047 | 0.87 | AURKA (0.54) | HRH3DRD2DRD3AURKAAURKB | |
| SCHEMBL5248611 | 0.87 | CHEK1 (0.44) | HRH3DRD2DRD3CREBBP | |
| SCHEMBL5300289 | 0.85 | DGAT1 (0.42) | DRD2DRD3HTR2AGNRHR | |
| SCHEMBL5256363 | 0.85 | CHEK1 (0.47) | HRH3DRD2DRD3 | |
| SCHEMBL5077332 | 0.83 | AURKA (0.58) | HRH3DRD2DRD3AURKAAURKB | |
| SCHEMBL5329494 | 0.81 | DRD4 (0.43) | DRD2DRD3HTR2AGNRHR | |
| SCHEMBL5255275 | 0.80 | TLR9 (0.46) | HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1257551-B1 | HETEROCYCLIC COMPOUNDS AND THEIR USE AS PARP INHIBITORS | ABBOTT GMBH & CO KG (DE) | 2007-09-05 | — | — | EP | disclosed |