Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22032867 | 0.83 | PIK3CA (0.39) | TP53CYP3A4 | |
| SCHEMBL22081879 | 0.72 | TP53 (0.35) | TP53CYP3A4 | |
| SCHEMBL30381092 | 0.72 | TP53 (0.35) | TP53CYP3A4 | |
| SCHEMBL2809035 | 0.71 | CYP3A4 (0.71) | TP53CYP3A4 | |
| SCHEMBL3506346 | 0.66 | — | — | |
| SCHEMBL30142177 | 0.66 | KDM4E (0.33) | — | |
| SCHEMBL23275267 | 0.64 | CCR1 (0.31) | — | |
| SCHEMBL22032908 | 0.64 | TP53 (0.41) | TP53CYP3A4 | |
| SCHEMBL24038711 | 0.64 | CYP3A4 (0.35) | TP53CYP3A4 | |
| SCHEMBL29762456 | 0.64 | CCR1 (0.31) | — |
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-2020117877-A1 | COMPOUNDS, COMPOSITIONS AND METHODS OF USE | AQUINNAH PHARMACEUTICALS, INC. (US) | 2020-06-11 | — | — | WO | disclosed |