Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGL | P06737 | 2/20 | 0.57 |
| ▸ | PYGM | P11217 | 2/20 | 0.57 |
| ▸ | XIAP | P98170 | 13/20 | 0.53 |
| ▸ | RIPK1 | Q13546 | 5/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL25343594 | 0.88 | PYGL (0.55) | PYGLPYGMRIPK1 | |
| SCHEMBL25343601 | 0.88 | PYGL (0.55) | PYGLPYGMRIPK1 | |
| SCHEMBL15414842 | 0.88 | PYGL (0.55) | PYGLPYGMRIPK1 | |
| SCHEMBL17310767 | 0.86 | PYGL (0.53) | PYGLPYGMXIAPRIPK1 | |
| Hydrochloric Acid SCHEMBL25343578 | 0.85 | PYGL (0.55) | PYGLPYGMRIPK1 | |
| Hydrochloric Acid SCHEMBL25343581 | 0.85 | PYGL (0.55) | PYGLPYGMRIPK1 | |
| SCHEMBL29481025 | 0.82 | PYGL (0.50) | PYGLPYGMRIPK1 | |
| SCHEMBL4216634 | 0.80 | PYGL (0.66) | PYGLPYGMRIPK1 | |
| SCHEMBL1976547 | 0.80 | PYGL (0.66) | PYGLPYGMRIPK1 | |
| SCHEMBL4232147 | 0.80 | PYGL (0.66) | PYGLPYGMRIPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2872490-A1 | ANTIPROLIFERATIVE BENZO [B]AZEPIN- 2 - ONES | F. Hoffmann-La Roche AG (CH) | 2015-05-20 | — | — | EP | disclosed |
| WO-2014009495-A1 | ANTIPROLIFERATIVE BENZO [B] AZEPIN- 2 - ONES | F. HOFFMANN-LA ROCHE AG (CH) | 2014-01-16 | — | — | WO | disclosed |