Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT2 | P31751 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | CD38 | P28907 | 1/20 | 0.30 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.30 |
| ▸ | AKT1 | P31749 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL16410633 | 0.80 | ACAT2 (0.37) | AKT2METAP2CNR1CNR2 | |
| SCHEMBL16410779 | 0.80 | CYP3A4 (0.35) | METAP2TP53CNR1CD38 | |
| SCHEMBL16410672 | 0.79 | ACAT2 (0.38) | METAP2CD38RPS6KB1AKT1 | |
| SCHEMBL16410737 | 0.74 | ACAT2 (0.35) | AKT2METAP2 | |
| SCHEMBL16410653 | 0.72 | KMT2A (0.32) | AKT2 | |
| SCHEMBL16410689 | 0.72 | EPHX2 (0.32) | — | |
| SCHEMBL16410840 | 0.71 | ACAT2 (0.42) | METAP2 | |
| SCHEMBL16410872 | 0.71 | PDE7A (0.35) | — | |
| SCHEMBL17757608 | 0.70 | CD38 (0.45) | TP53CD38RPS6KB1AKT1 | |
| SCHEMBL16410643 | 0.70 | ACAT2 (0.35) | AKT2METAP2TP53CNR1 |
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 |