Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 15/20 | 0.48 |
| ▸ | GSK3B | P49841 | 15/20 | 0.48 |
| ▸ | AURKA | O14965 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | RAB29 | O14966 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | YES1 | P07947 | 1/20 | 0.41 |
| ▸ | LYN | P07948 | 1/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3527708 | 0.90 | GSK3A (0.57) | GSK3AGSK3BLMNAHTTRAB9A | |
| SCHEMBL3521643 | 0.88 | GSK3A (0.43) | GSK3AGSK3BAURKACYP1A2SMN1; SMN2 | |
| SCHEMBL3529920 | 0.87 | GSK3A (0.61) | GSK3AGSK3BLMNAHTTRAB9A | |
| SCHEMBL5549831 | 0.86 | GSK3A (0.50) | GSK3AGSK3BLMNAHTTRAB9A | |
| SCHEMBL5550070 | 0.86 | GSK3A (0.50) | GSK3AGSK3BLMNAHTTRAB9A | |
| SCHEMBL5548893 | 0.86 | GSK3A (0.49) | GSK3AGSK3BAURKACYP3A4LMNA | |
| SCHEMBL3525341 | 0.85 | GSK3B (0.48) | GSK3AGSK3BAURKALMNAHTT | |
| SCHEMBL3526786 | 0.84 | GSK3B (0.56) | GSK3AGSK3B | |
| SCHEMBL5548595 | 0.84 | GSK3B (0.48) | GSK3AGSK3BLMNASMN1; SMN2 | |
| SCHEMBL5545002 | 0.83 | GSK3A (0.51) | GSK3AGSK3B |
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-1678180-B1 | SUBSTITUTED 2H-[1,2,4]TRIAZOLO 4,3-A PYRAZINES AS GSK-3 INHIBITORS | PFIZER PROD INC (US) | 2007-08-08 | — | — | EP | disclosed |