Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 12/20 | 0.43 |
| ▸ | GSK3A | P49840 | 11/20 | 0.41 |
| ▸ | TTBK1 | Q5TCY1 | 1/20 | 0.36 |
| ▸ | TTBK2 | Q6IQ55 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | ILK | Q13418 | 1/20 | 0.36 |
| ▸ | ESRRB | O95718 | 2/20 | 0.36 |
| ▸ | ESRRG | P62508 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5543493 | 0.89 | GSK3B (0.50) | ADORA1GSK3BGSK3AGPR84 | |
| SCHEMBL3528033 | 0.88 | GSK3B (0.56) | ADORA1GSK3BGSK3A | |
| SCHEMBL5545429 | 0.88 | GSK3B (0.46) | ADORA1GSK3BGSK3A | |
| SCHEMBL5549014 | 0.87 | CA1 (0.49) | ADORA1 | |
| SCHEMBL5545525 | 0.85 | ADORA1 (0.47) | ADORA1GSK3BGSK3A | |
| SCHEMBL3526786 | 0.85 | GSK3B (0.56) | ADORA1GSK3BGSK3A | |
| SCHEMBL5549261 | 0.84 | KMT2A (0.48) | — | |
| SCHEMBL3529268 | 0.83 | ADORA1 (0.37) | ADORA1GSK3BGSK3A | |
| SCHEMBL5545556 | 0.83 | GSK3A (0.48) | ADORA1GSK3BGSK3A | |
| SCHEMBL3525610 | 0.82 | GSK3B (0.55) | ADORA1GSK3BGSK3A |
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 |