Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CES2 | O00748 | 1/20 | 0.30 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL25646278 | 0.85 | — | — | |
| SCHEMBL18738003 | 0.84 | PPARG (0.38) | TSHR | |
| SCHEMBL257866 | 0.84 | TRPA1 (0.31) | TRPA1ALDH1A1TSHR | |
| SCHEMBL21185094 | 0.83 | PPARA (0.41) | ALDH1A1TSHR | |
| SCHEMBL20108615 | 0.83 | ABAT (0.36) | — | |
| SCHEMBL20108670 | 0.80 | MAPT (0.31) | — | |
| SCHEMBL12810760 | 0.79 | RXRA (0.42) | ALDH1A1TSHR | |
| SCHEMBL18636296 | 0.79 | — | — | |
| SCHEMBL8281890 | 0.78 | ESR1 (0.37) | ALDH1A1TSHR | |
| SCHEMBL14038082 | 0.78 | TSHR (0.33) | ALDH1A1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005060456-A2 | METHOD FOR TREATING ADAMTS-5-ASSOCIATE DISEASE | WYETH (US) | 2005-07-07 | — | — | WO | disclosed |
| WO-2005061459-A1 | BIARYL SULFONAMIDES AND METHODS FOR USING SAME | WYETH (US) | 2005-07-07 | — | — | WO | disclosed |