Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 2/20 | 0.36 |
| ▸ | GHSR | Q92847 | 4/20 | 0.30 |
| ▸ | PDE9A | O76083 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL17757628 | 0.89 | MAOB (0.36) | GHSRMAOAMAOBEGFR | |
| SCHEMBL17757510 | 0.81 | ACAT2 (0.43) | MAOAMAOBEGFR | |
| SCHEMBL16410798 | 0.81 | MAOA (0.35) | GHSRMAOAMAOB | |
| SCHEMBL17757633 | 0.79 | SMN1; SMN2 (0.39) | — | |
| SCHEMBL17757642 | 0.77 | MAOB (0.36) | PDE9AMAOB | |
| SCHEMBL17757436 | 0.77 | MAOB (0.36) | PDE9AMAOB | |
| SCHEMBL17757592 | 0.77 | PDE7A (0.38) | PDE9AMAOB | |
| SCHEMBL17757625 | 0.76 | GRM4 (0.38) | PDE9AMAOBEGFR | |
| SCHEMBL21982604 | 0.76 | MAOB (0.37) | GHSRMAOAMAOBEGFR | |
| SCHEMBL17757131 | 0.76 | CYP3A4 (0.36) | PDE9AMAOBEGFR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3021847-B1 | SPIROQUINOXALINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH | HELMHOLTZ ZENTRUM MUENCHEN DEUTSCHES FORSCHUNGSZENTRUM GESUNDHEIT & UMWELT GMBH (DE) | 2023-06-07 | — | — | EP | disclosed |