Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ACE | P12821 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11262760 | 1.00 | ALDH1A1 (0.33) | ALDH1A1TSHRACE | |
| SCHEMBL11262772 | 1.00 | ALDH1A1 (0.33) | ALDH1A1TSHRACE | |
| SCHEMBL11264120 | 0.87 | ACE (0.44) | ALDH1A1ACE | |
| SCHEMBL11264125 | 0.87 | ACE (0.44) | ALDH1A1ACE | |
| SCHEMBL11275389 | 0.83 | ACE (0.43) | ACE | |
| SCHEMBL11275384 | 0.83 | ACE (0.43) | ACE | |
| SCHEMBL19084015 | 0.80 | TSHR (0.33) | TSHR | |
| SCHEMBL17428585 | 0.74 | ATM (0.36) | — | |
| SCHEMBL19083693 | 0.74 | ATM (0.36) | — | |
| SCHEMBL20697815 | 0.70 | PIK3CD (0.35) | — |
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-4321392-A | Mercaptoacyl derivatives of 4-oxazolidine-carboxylic acids | E. R. SQUIBB & SONS, INC. (US) | 1982-03-23 | — | — | US | disclosed |