Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.84 |
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 | |
|---|---|---|---|---|
| Pentaerythritol Tetranitrate SCHEMBL920358 | 0.92 | ALDH1A1 (1.00) | ALDH1A1 | |
| Pentaerythritol Tetranitrate SCHEMBL37177 | 0.92 | ALDH1A1 (1.00) | ALDH1A1 | |
| Pentaerythritol Tetranitrate SCHEMBL5940085 | 0.89 | ALDH1A1 (0.94) | ALDH1A1 | |
| Pentaerythritol Tetranitrate SCHEMBL1028496 | 0.84 | ALDH1A1 (0.84) | ALDH1A1 | |
| Pentaerythritol Tetranitrate SCHEMBL6686407 | 0.83 | ALDH1A1 (0.73) | ALDH1A1 | |
| Pentaerythritol Tetranitrate SCHEMBL15543872 | 0.80 | ALDH1A1 (0.76) | ALDH1A1 | |
| SCHEMBL7891079 | 0.80 | ALDH1A1 (0.76) | ALDH1A1 | |
| SCHEMBL7894787 | 0.77 | ALDH1A1 (0.71) | ALDH1A1 | |
| SCHEMBL8277378 | 0.77 | ALDH1A1 (0.71) | ALDH1A1 | |
| Pentrinitrol SCHEMBL122322 | 0.77 | ALDH1A1 (0.71) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6180664-B1 | CARDIOVASCUALR DISORDERS; IMPOTENCY | ISIS PHARMA GMBH (DE) | 2001-01-30 | — | — | US | disclosed |
| EP-1009730-A1 | NEW PENTAERYTHRITOL DERIVATIVES, THEIR PRODUCTION AND USE AND INTERMEDIATES FOR THEIR SYNTHESIS | ISIS PHARMA GmbH (DE) | 2000-06-21 | — | — | EP | disclosed |
| WO-1998015521-A1 | NEW PENTAERYTHRITOL DERIVATIVES, THEIR PRODUCTION AND USE AND INTERMEDIATES FOR THEIR SYNTHESIS | ISIS PHARMA GMBH (DE) | 1998-04-16 | — | — | WO | disclosed |