Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL29482737 | 0.89 | TRPA1 (0.36) | TRPA1ALDH1A1TSHR | |
| SCHEMBL29482738 | 0.89 | TRPA1 (0.36) | TRPA1ALDH1A1TSHR | |
| SCHEMBL642402 | 0.87 | IDO1 (0.40) | IDO1TRPA1ALDH1A1TSHR | |
| SCHEMBL22110461 | 0.84 | IDO1 (0.44) | IDO1TSHR | |
| SCHEMBL400236 | 0.81 | IDO1 (0.46) | IDO1TRPA1ALDH1A1TSHR | |
| SCHEMBL24150147 | 0.78 | ACHE (0.39) | — | |
| SCHEMBL13973047 | 0.75 | ACHE (0.40) | IDO1TRPA1ALDH1A1TSHR | |
| SCHEMBL331501 | 0.74 | TRPA1 (0.47) | TRPA1ALDH1A1TSHR | |
| SCHEMBL5442950 | 0.74 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL28056120 | 0.73 | TACR1 (0.40) | IDO1ALDH1A1 |
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-5877214-A | Polyaryl-poly(ethylene glycol) supports for solution-phase combinatorial synthesis | MERCK & CO., INC. (US) | 1999-03-02 | — | — | US | disclosed |