Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL27793 | 0.83 | CD81 (0.35) | ALDH1A1 | |
| SCHEMBL150232 | 0.83 | CD81 (0.35) | ALDH1A1 | |
| SCHEMBL6656802 | 0.82 | GRIK1 (0.39) | TDP1ALDH1A1TSHR | |
| SCHEMBL6656799 | 0.82 | GRIK1 (0.39) | TDP1ALDH1A1TSHR | |
| SCHEMBL445565 | 0.81 | TDP1 (0.31) | TDP1ALDH1A1 | |
| Acetone SCHEMBL29420371 | 0.81 | CD81 (0.34) | — | |
| SCHEMBL445566 | 0.81 | TDP1 (0.31) | TDP1ALDH1A1 | |
| SCHEMBL30808136 | 0.81 | TDP1 (0.31) | TDP1ALDH1A1 | |
| Trimethylammonium SCHEMBL8162325 | 0.78 | CD81 (0.33) | — | |
| Trimethylammonium SCHEMBL8162321 | 0.78 | CD81 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009123355-A2 | COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2009-10-08 | — | — | WO | disclosed |