Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACAT2 | Q9BWD1 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 3/20 | 0.37 |
| ▸ | HTR6 | P50406 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | APP | P05067 | 2/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17757475 | 0.90 | ACAT2 (0.43) | ACAT2MAOBHTR6LMNAMAPT | |
| SCHEMBL17757746 | 0.90 | HRH4 (0.42) | ACAT2MAOBHTR6LMNAMAPT | |
| SCHEMBL17758032 | 0.90 | ACAT2 (0.39) | ACAT2MAOBHTR6LMNAMAPT | |
| SCHEMBL17757449 | 0.88 | ACAT2 (0.42) | ACAT2MAOBHTR6LMNAMAPT | |
| SCHEMBL17757440 | 0.88 | ACAT2 (0.42) | ACAT2MAOBHTR6LMNAMAPT | |
| SCHEMBL17757755 | 0.88 | ACAT2 (0.37) | ACAT2MAOBHTR6LMNAMAPT | |
| SCHEMBL17757740 | 0.88 | ACAT2 (0.37) | ACAT2MAOBHTR6LMNAMAPT | |
| SCHEMBL17757470 | 0.87 | ACAT2 (0.41) | ACAT2MAOBHTR6LMNAMAPT | |
| SCHEMBL17757234 | 0.87 | ACAT2 (0.41) | ACAT2MAOBHTR6LMNAMAPT | |
| SCHEMBL17757443 | 0.87 | ACAT2 (0.41) | ACAT2MAOBHTR6LMNAMAPT |
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 |