Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACAT2 | Q9BWD1 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PDE7A | Q13946 | 4/20 | 0.34 |
| ▸ | PDE5A | O76074 | 2/20 | 0.32 |
| ▸ | PDE1A | P54750 | 2/20 | 0.32 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.32 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 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 | |
|---|---|---|---|---|
| SCHEMBL16410784 | 0.90 | ACAT2 (0.43) | ACAT2KMT2A | |
| SCHEMBL16410738 | 0.89 | ACAT2 (0.36) | ACAT2 | |
| SCHEMBL16410755 | 0.86 | ACAT2 (0.43) | ACAT2KMT2APDE7A | |
| SCHEMBL16410816 | 0.82 | ACAT2 (0.45) | ACAT2KMT2APDE7A | |
| SCHEMBL16410620 | 0.77 | ACAT2 (0.36) | ACAT2KMT2APDE7A | |
| SCHEMBL16410750 | 0.76 | ACAT2 (0.39) | ACAT2KMT2APDE7A | |
| SCHEMBL16410770 | 0.76 | ACAT2 (0.44) | ACAT2KMT2APDE7APDE7B | |
| SCHEMBL17757643 | 0.76 | KMT2A (0.40) | KMT2APDE7APDE5APDE1APDE1B | |
| SCHEMBL16410766 | 0.76 | ACAT2 (0.47) | ACAT2 | |
| SCHEMBL17757626 | 0.76 | KMT2A (0.40) | KMT2APDE7APDE5APDE1APDE1B |
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-2015007730-A1 | SPIROQUINOXALINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH | Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) | 2015-01-22 | — | — | WO | disclosed |