Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 16/20 | 0.34 |
| ▸ | GSK3A | P49840 | 15/20 | 0.34 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | NUDT1 | P36639 | 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 | |
|---|---|---|---|---|
| SCHEMBL3529268 | 0.85 | ADORA1 (0.37) | GSK3BGSK3AADORA1 | |
| SCHEMBL3521775 | 0.85 | GSK3B (0.36) | GSK3BGSK3AADORA1 | |
| SCHEMBL5545590 | 0.85 | GSK3B (0.35) | GSK3BGSK3AADORA1 | |
| SCHEMBL3525674 | 0.83 | GSK3B (0.42) | GSK3BGSK3AADORA1 | |
| SCHEMBL5543598 | 0.83 | HSD17B10 (0.43) | GSK3BGSK3AADORA1 | |
| SCHEMBL3522887 | 0.83 | SYK (0.34) | GSK3BGSK3AADORA1 | |
| SCHEMBL5548899 | 0.83 | GSK3B (0.32) | GSK3BGSK3AADORA1 | |
| SCHEMBL5543751 | 0.82 | LMNA (0.39) | — | |
| SCHEMBL5549142 | 0.82 | GSK3B (0.35) | GSK3BGSK3AADORA1 | |
| SCHEMBL3528837 | 0.82 | GSK3B (0.47) | GSK3BGSK3AADORA1 |
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 |