Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ACAT2 | Q9BWD1 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL16410739 | 0.99 | KMT2A (0.39) | KMT2AACAT2KDM4EMAPTSSTR3 | |
| SCHEMBL16410778 | 0.89 | LMNA (0.38) | KDM4EMAPTNPC1GAAMAPK1 | |
| SCHEMBL16410538 | 0.88 | KMT2A (0.32) | KMT2A | |
| SCHEMBL17757634 | 0.87 | KMT2A (0.39) | KMT2AACAT2KDM4EMAPTSSTR3 | |
| SCHEMBL16410619 | 0.86 | LOXL2 (0.33) | KMT2AACAT2 | |
| SCHEMBL16410606 | 0.86 | ACAT2 (0.40) | KMT2AACAT2KDM4EMAPTPDE7A | |
| SCHEMBL14398518 | 0.86 | KMT2A (0.41) | KMT2AACAT2KDM4EMAPTSSTR3 | |
| SCHEMBL17757653 | 0.86 | KMT2A (0.41) | KMT2AACAT2KDM4EMAPTSSTR3 | |
| SCHEMBL17757467 | 0.86 | KMT2A (0.41) | KMT2AACAT2KDM4EMAPTSSTR3 | |
| SCHEMBL16410867 | 0.85 | ALDH1A1 (0.34) | KMT2AACAT2NPC1GAARAB9A |
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 |