Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.33 |
| ▸ | CDC25A | P30304 | 1/20 | 0.33 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CETP | P11597 | 5/20 | 0.31 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.31 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Royleanone SCHEMBL21291506 | 0.74 | CYP3A4 (0.44) | TP53CYP3A4CYP19A1USP2HSP90AA1 | |
| SCHEMBL22861865 | 0.70 | FDPS (0.34) | TP53CYP3A4CYP19A1FDPSEP300 | |
| SCHEMBL21291526 | 0.70 | FDPS (0.34) | TP53CYP3A4CYP19A1FDPSEP300 | |
| SCHEMBL22862021 | 0.66 | EP300 (0.32) | EP300 | |
| SCHEMBL22862020 | 0.66 | EP300 (0.32) | EP300 | |
| SCHEMBL15732245 | 0.66 | EP300 (0.46) | TP53CYP3A4CYP19A1USP2HSP90AA1 | |
| SCHEMBL22861861 | 0.64 | EP300 (0.31) | EP300 | |
| SCHEMBL22861862 | 0.64 | EP300 (0.31) | EP300 | |
| SCHEMBL22861873 | 0.64 | FDPS (0.30) | FDPSEP300 | |
| Taiwaniaquinone G SCHEMBL31237701 | 0.63 | TSHR (0.36) | TP53CYP3A4CYP19A1TSHRFDPS |
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-2019158359-A1 | COMPOUNDS THAT MODULATE VON WILLEBRAND FACTOR LEVELS AND THEIR USE IN THE TREATMENT OF BLOOD DISORDERS | SOCIETE DES PRODUITS NESTLE S.A. (CH) | 2019-08-22 | — | — | WO | disclosed |