Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.34 |
| ▸ | SLC2A4 | P14672 | 1/20 | 0.32 |
| ▸ | STAT6 | P42226 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.30 |
| ▸ | ROCK2 | O75116 | 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 | |
|---|---|---|---|---|
| SCHEMBL16410793 | 0.88 | CYP1A2 (0.34) | CYP1A2CYP3A4PKMALOX15NFKB1 | |
| SCHEMBL16410731 | 0.83 | KDM4E (0.30) | KDM4E | |
| SCHEMBL16410822 | 0.79 | HTT (0.34) | PKMLMNA | |
| SCHEMBL16410701 | 0.78 | PIK3CA (0.33) | PIK3CA | |
| SCHEMBL16410718 | 0.78 | PIK3CA (0.34) | CYP3A4STAT6PIK3CA | |
| SCHEMBL16410626 | 0.77 | NOS3 (0.34) | MAPK1STAT6PIK3CA | |
| SCHEMBL16410536 | 0.76 | TSHR (0.35) | KMT2A | |
| SCHEMBL16410683 | 0.72 | PIK3CA (0.32) | STAT6PIK3CA | |
| SCHEMBL16410595 | 0.72 | P2RX7 (0.32) | LMNAMAPT | |
| SCHEMBL16410820 | 0.71 | KDM4E (0.30) | KDM4E |
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 |