Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 4/20 | 0.33 |
| ▸ | CASP3 | P42574 | 4/20 | 0.33 |
| ▸ | CASP7 | P55210 | 4/20 | 0.33 |
| ▸ | CASP8 | Q14790 | 3/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5545476 | 0.74 | ADORA1 (0.39) | ADORA1 | |
| SCHEMBL5549333 | 0.74 | GSK3B (0.36) | ADORA1 | |
| SCHEMBL5545518 | 0.73 | GSK3A (0.37) | CASP1CASP7ADORA1 | |
| SCHEMBL3527204 | 0.73 | GSK3A (0.41) | — | |
| SCHEMBL5549013 | 0.72 | ALPL (0.41) | ADORA1 | |
| SCHEMBL5543524 | 0.72 | ADORA1 (0.43) | ADORA1 | |
| SCHEMBL5550007 | 0.72 | KAT2B (0.39) | — | |
| SCHEMBL5549416 | 0.70 | PDE5A (0.40) | — | |
| SCHEMBL5543614 | 0.69 | PDE10A (0.40) | ADORA1 | |
| SCHEMBL5545549 | 0.69 | CASP1 (0.43) | CASP1CASP3CASP7CASP8ADORA1 |
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 |