Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.47 |
| ▸ | GSK3B | P49841 | 10/20 | 0.40 |
| ▸ | GSK3A | P49840 | 9/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | FES | P07332 | 1/20 | 0.39 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.39 |
| ▸ | FLT4 | P35916 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.35 |
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 | 0.85 | GSK3B (0.50) | ADORA1GSK3BGSK3A | |
| SCHEMBL5549402 | 0.85 | ADORA1 (0.43) | ADORA1GSK3BGSK3A | |
| SCHEMBL5545556 | 0.85 | GSK3A (0.48) | ADORA1GSK3BGSK3A | |
| SCHEMBL5548893 | 0.84 | GSK3A (0.49) | ADORA1GSK3BGSK3A | |
| SCHEMBL3528033 | 0.84 | GSK3B (0.56) | ADORA1GSK3BGSK3A | |
| SCHEMBL5549283 | 0.84 | GSK3B (0.58) | ADORA1GSK3BGSK3A | |
| SCHEMBL5549014 | 0.82 | CA1 (0.49) | ADORA1CA1CA2CA9 | |
| SCHEMBL5550039 | 0.80 | GSK3A (0.46) | ADORA1GSK3BGSK3A | |
| SCHEMBL5543514 | 0.79 | GSK3B (0.40) | ADORA1GSK3BGSK3A | |
| SCHEMBL5545517 | 0.79 | GSK3B (0.54) | 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 |