Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | DDB1 | Q16531 | 2/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
| ▸ | GLS | O94925 | 1/20 | 0.34 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25604262 | 0.91 | ESR2 (0.46) | SMN1; SMN2ESR2NR1H2MAPTMAPK1 | |
| SCHEMBL25604198 | 0.91 | ESR2 (0.46) | SMN1; SMN2ESR2DDB1CRBNNR1H2 | |
| SCHEMBL25825902 | 0.88 | L3MBTL1 (0.39) | SMN1; SMN2ESR2DDB1CRBNNR1H2 | |
| SCHEMBL25604354 | 0.85 | SMN1; SMN2 (0.42) | SMN1; SMN2ESR2NR1H2MAPTGPR119 | |
| SCHEMBL25825839 | 0.83 | SMN1; SMN2 (0.40) | SMN1; SMN2NR1H2MAPTGPR119SCD5 | |
| SCHEMBL25604199 | 0.79 | ESR2 (0.43) | SMN1; SMN2ESR2NR1H2HDAC1MAPT | |
| SCHEMBL25604141 | 0.79 | MAPT (0.46) | SMN1; SMN2ESR2DDB1CRBNNR1H2 | |
| SCHEMBL25604356 | 0.74 | ESR2 (0.39) | SMN1; SMN2ESR2NR1H2GPR119 | |
| SCHEMBL25604506 | 0.73 | SMN1; SMN2 (0.44) | SMN1; SMN2MAPT | |
| SCHEMBL15042246 | 0.72 | DDB1 (0.50) | ESR2DDB1CRBNNR1H2HDAC1 |
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-2023125944-A1 | COMPOUND CONTAINING HETEROCYCLIC RING | 正大天晴药业集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |