Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL4648009 | 0.87 | ALDH1A1 (0.64) | ALDH1A1TSHRTP53CYP3A4THRB | |
| SCHEMBL4642539 | 0.85 | ALDH1A1 (0.40) | ALDH1A1TP53CYP3A4 | |
| SCHEMBL4866874 | 0.80 | ALDH1A1 (0.66) | ALDH1A1TSHRTP53CYP3A4THRB | |
| SCHEMBL7607159 | 0.79 | ALDH1A1 (0.64) | ALDH1A1TSHRTP53CYP3A4THRB | |
| SCHEMBL7517250 | 0.78 | ALDH1A1 (0.71) | ALDH1A1TSHRTP53CYP3A4THRB | |
| SCHEMBL596349 | 0.78 | ALDH1A1 (0.62) | ALDH1A1TSHRTP53CYP3A4THRB | |
| SCHEMBL4644701 | 0.77 | ALDH1A1 (0.60) | ALDH1A1TSHRTP53CYP3A4THRB | |
| SCHEMBL2048901 | 0.76 | ALDH1A1 (1.00) | ALDH1A1TSHRTP53CYP3A4THRB | |
| SCHEMBL5098171 | 0.76 | ALDH1A1 (1.00) | ALDH1A1TSHRTP53CYP3A4THRB | |
| SCHEMBL15617 | 0.76 | ALDH1A1 (1.00) | ALDH1A1TSHRTP53CYP3A4THRB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1591098-B1 | Cationically curable composition for dental use | TOKUYAMA CORP (JP) | 2008-08-13 | — | — | EP | disclosed |
| US-7365106-B2 | Cationically curable composition for dental use | TOKUYAMA CORPORATION (JP) | 2008-04-29 | — | — | US | disclosed |
| US-20050250868-A1 | Cationically curable composition for dental use | TOKUYAMA CORPORATION (JP) | 2005-11-10 | — | — | US | disclosed |
| EP-1591098-A1 | Cationically curable composition for dental use | TOKUYAMA CORPORATION (JP) | 2005-11-02 | — | — | EP | disclosed |