Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NLRP3 | Q96P20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7319284 | 0.83 | TSHR (0.40) | ALDH1A1TSHRNLRP3 | |
| SCHEMBL21532631 | 0.83 | ALDH1A1 (0.36) | ALDH1A1TSHR | |
| SCHEMBL2562308 | 0.82 | TSHR (0.31) | ALDH1A1TSHRNLRP3 | |
| SCHEMBL29955267 | 0.75 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL13601936 | 0.75 | TSHR (0.44) | ALDH1A1TSHRNLRP3 | |
| SCHEMBL23735583 | 0.74 | MAPK1 (0.41) | ALDH1A1TSHRNLRP3 | |
| SCHEMBL15331649 | 0.74 | MEN1 (0.33) | ALDH1A1 | |
| SCHEMBL29954794 | 0.74 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL29956145 | 0.73 | ALDH1A1 (0.38) | ALDH1A1TSHR | |
| SCHEMBL11668657 | 0.73 | TSHR (0.40) | ALDH1A1TSHRNLRP3 |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |