Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACAT2 | Q9BWD1 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.31 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.31 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
| ▸ | CD38 | P28907 | 1/20 | 0.31 |
| ▸ | GABRP | O00591 | 1/20 | 0.31 |
| ▸ | GABRD | O14764 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 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 | |
|---|---|---|---|---|
| SCHEMBL16410779 | 0.92 | CYP3A4 (0.35) | APEX1ROCK2METAP2CD38GABRP | |
| SCHEMBL17757777 | 0.80 | CD38 (0.44) | ACAT2MAOBHTR6CD38HDAC3 | |
| SCHEMBL16410703 | 0.79 | AKT2 (0.33) | METAP2CD38RPS6KB1AKT1 | |
| SCHEMBL17757774 | 0.79 | ACAT2 (0.39) | ACAT2CHRM3MAOBHTR6APEX1 | |
| SCHEMBL17757770 | 0.78 | ACAT2 (0.39) | ACAT2SSTR1SSTR4MAOBHTR6 | |
| SCHEMBL16410868 | 0.76 | MAPK1 (0.33) | — | |
| SCHEMBL17757768 | 0.74 | ACAT2 (0.43) | ACAT2MAOBHTR6CCNT1HDAC3 | |
| SCHEMBL16410641 | 0.74 | ACAT2 (0.42) | ACAT2MAOBHTR6CCNT1 | |
| SCHEMBL16410840 | 0.74 | ACAT2 (0.42) | ACAT2METAP2GAA | |
| SCHEMBL16410872 | 0.74 | PDE7A (0.35) | CCNT1 |
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 |