Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACAT2 | Q9BWD1 | 3/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | HUWE1 | Q7Z6Z7 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17757285 | 0.92 | ACAT2 (0.35) | ACAT2 | |
| SCHEMBL17757120 | 0.90 | PIM1 (0.35) | ACAT2PIM1HUWE1NPC1RAB9A | |
| SCHEMBL17757732 | 0.89 | ACAT2 (0.38) | ACAT2 | |
| SCHEMBL17757521 | 0.88 | PIM1 (0.36) | PIM1HUWE1NPC1RAB9AATM | |
| SCHEMBL17757362 | 0.88 | PIM1 (0.34) | ACAT2PIM1HUWE1NPC1RAB9A | |
| SCHEMBL17757203 | 0.87 | ACAT2 (0.38) | ACAT2NPC1RAB9AATM | |
| SCHEMBL17757281 | 0.87 | ACAT2 (0.53) | ACAT2 | |
| SCHEMBL17757294 | 0.87 | CTSB (0.39) | ACAT2NPC1RAB9A | |
| SCHEMBL17757718 | 0.87 | ACAT2 (0.38) | ACAT2 | |
| SCHEMBL17757295 | 0.87 | ACAT2 (0.38) | ACAT2 |
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-2016075137-A1 | SPIROPYRAZINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH | Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) | 2016-05-19 | — | — | WO | disclosed |