Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | HRH2 | P25021 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.31 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
| ▸ | ACAT2 | Q9BWD1 | 1/20 | 0.30 |
| ▸ | APP | P05067 | 1/20 | 0.30 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.30 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL17758053 | 0.90 | MEN1 (0.36) | MEN1KMT2ASSTR3KDM1AMAOA | |
| SCHEMBL16410778 | 0.88 | LMNA (0.38) | LMNA | |
| SCHEMBL16410841 | 0.88 | KDM1A (0.32) | KDM1AACAT2APPATG4BLMNA | |
| SCHEMBL16410832 | 0.85 | KDM4E (0.35) | MEN1KMT2AROCK1 | |
| SCHEMBL16410840 | 0.82 | ACAT2 (0.42) | KMT2AMETAP2ACAT2APPLMNA | |
| SCHEMBL16410799 | 0.80 | LMNA (0.32) | LMNA | |
| SCHEMBL16410606 | 0.79 | ACAT2 (0.40) | KMT2AACAT2 | |
| SCHEMBL17757232 | 0.79 | SSTR3 (0.38) | KMT2ASSTR3KDM1AMAOAMAOB | |
| SCHEMBL16410721 | 0.78 | SIGMAR1 (0.33) | MEN1KMT2ASSTR3LMNA | |
| SCHEMBL17758049 | 0.78 | ACAT2 (0.43) | MEN1KMT2AMAOBACAT2APP |
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 |