Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL22917267 | 0.76 | ALDH1A1 (0.38) | ALDH1A1CES2CES1TP53 | |
| SCHEMBL12928359 | 0.74 | ALDH1A1 (0.52) | ALDH1A1CES2CES1EPHX2TP53 | |
| SCHEMBL21786999 | 0.70 | CES2 (0.36) | ALDH1A1CES2CES1 | |
| SCHEMBL20105240 | 0.70 | EPHX2 (0.34) | ALDH1A1EPHX2 | |
| SCHEMBL704007 | 0.69 | — | — | |
| SCHEMBL19519623 | 0.69 | — | — | |
| SCHEMBL23613229 | 0.68 | ALDH1A1 (0.35) | ALDH1A1CES2CES1 | |
| SCHEMBL22473757 | 0.68 | LMNA (0.38) | ALDH1A1CES2CES1 | |
| SCHEMBL27967115 | 0.68 | LMNA (0.38) | ALDH1A1CES2CES1 | |
| SCHEMBL27699029 | 0.68 | ALDH1A1 (0.50) | ALDH1A1CES2CES1EPHX2TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-12024614-B2 | Rubber compounding ingredient and rubber composition | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2024-07-02 | — | — | US | disclosed |