Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL65467 | 0.85 | TRPA1 (0.41) | TRPA1TRPM8EPHX1MEN1ALDH1A1 | |
| SCHEMBL7979 | 0.84 | TRPA1 (0.39) | TRPA1TRPM8EPHX1MEN1ALDH1A1 | |
| SCHEMBL452781 | 0.84 | TRPA1 (0.39) | TRPA1TRPM8EPHX1MEN1ALDH1A1 | |
| SCHEMBL1760669 | 0.84 | TRPA1 (0.39) | TRPA1TRPM8EPHX1MEN1ALDH1A1 | |
| Bicarbonate SCHEMBL10767839 | 0.83 | EPHX1 (0.39) | TRPA1TRPM8EPHX1MEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6863594 | 0.82 | TRPA1 (0.37) | TRPA1TRPM8EPHX1 | |
| Calcium SCHEMBL31756866 | 0.82 | TRPA1 (0.37) | TRPA1TRPM8EPHX1 | |
| Charcoal, Activated SCHEMBL4530459 | 0.82 | TRPA1 (0.37) | TRPA1TRPM8EPHX1 | |
| SCHEMBL38654752 | 0.82 | TRPA1 (0.37) | TRPA1TRPM8EPHX1ALDH1A1 | |
| SCHEMBL28548272 | 0.82 | TRPA1 (0.37) | TRPA1TRPM8EPHX1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0721323-A1 | DIPHOSPHONIC ACID ESTERS AS TARTAR CONTROL AGENTS | THE PROCTER & GAMBLE COMPANY (US) | 1996-07-17 | — | — | EP | disclosed |
| US-5451401-A | Diphosphonic acid esters as tartar control agents | THE PROCTER & GAMBLE COMPANY (US) | 1995-09-19 | — | — | US | disclosed |
| WO-1995008979-A1 | DIPHOSPHONIC ACID ESTERS AS TARTAR CONTROL AGENTS | THE PROCTER & GAMBLE COMPANY (US) | 1995-04-06 | — | — | WO | disclosed |