Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL5326915 | 1.00 | CYP1A2 (0.38) | CYP1A2KDM4EALDH1A1TDP1 | |
| SCHEMBL14994547 | 0.79 | CYP1A2 (0.40) | CYP1A2KDM4E | |
| SCHEMBL1897801 | 0.74 | CYP1A2 (0.37) | CYP1A2 | |
| SCHEMBL5326914 | 0.74 | CYP1A2 (0.37) | CYP1A2 | |
| SCHEMBL8972466 | 0.70 | CYP1A2 (0.33) | CYP1A2 | |
| SCHEMBL7702698 | 0.70 | CYP1A2 (0.41) | CYP1A2 | |
| SCHEMBL5435204 | 0.70 | CYP1A2 (0.41) | CYP1A2 | |
| SCHEMBL25831055 | 0.69 | CYP1A2 (0.40) | CYP1A2KDM4E | |
| SCHEMBL2295962 | 0.69 | CYP1A2 (0.41) | CYP1A2 | |
| SCHEMBL25830926 | 0.68 | CYP1A2 (0.57) | CYP1A2KDM4EALDH1A1TDP1 |
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-2011056759-A2 | ORAL COMPOSITIONS FOR TREATMENT OF DRY MOUTH | THE PROCTER & GAMBLE COMPANY (US) | 2011-05-12 | — | — | WO | disclosed |