Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL16410822 | 0.76 | HTT (0.34) | POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL16410536 | 0.74 | TSHR (0.35) | ACHEALDH1A1MEN1KMT2A | |
| SCHEMBL16410722 | 0.68 | OGA (0.32) | ACHESMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL16410539 | 0.66 | EPHX2 (0.38) | MEN1KMT2A | |
| SCHEMBL17758073 | 0.65 | HPGD (0.37) | SIGMAR1POLBMEN1KMT2A | |
| SCHEMBL16410623 | 0.65 | SSTR3 (0.36) | SIGMAR1MEN1KMT2A | |
| SCHEMBL16410668 | 0.65 | ACAT2 (0.34) | SIGMAR1ALDH1A1MEN1KMT2A | |
| SCHEMBL16410721 | 0.64 | SIGMAR1 (0.33) | SIGMAR1ALDH1A1MEN1KMT2A | |
| SCHEMBL17992026 | 0.62 | SIGMAR1 (0.35) | SIGMAR1POLBALDH1A1KMT2A | |
| SCHEMBL17758088 | 0.60 | OGA (0.37) | ACHESMN1; SMN2ALDH1A1MEN1KMT2A |
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 |