Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 12/20 | 0.36 |
| ▸ | GSK3A | P49840 | 11/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | LTK | P29376 | 1/20 | 0.33 |
| ▸ | GRK5 | P34947 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.33 |
| ▸ | MST1R | Q04912 | 1/20 | 0.33 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 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 | |
|---|---|---|---|---|
| SCHEMBL5545590 | 0.83 | GSK3B (0.35) | ADORA1GSK3BGSK3A | |
| SCHEMBL5545556 | 0.83 | GSK3A (0.48) | ADORA1GSK3BGSK3A | |
| SCHEMBL5549333 | 0.83 | GSK3B (0.36) | ADORA1GSK3BGSK3A | |
| SCHEMBL5543567 | 0.82 | ADORA1 (0.47) | ADORA1GSK3BGSK3A | |
| SCHEMBL5548893 | 0.82 | GSK3A (0.49) | ADORA1GSK3BGSK3APOLB | |
| SCHEMBL5550127 | 0.81 | CYP3A4 (0.37) | PDE5A | |
| SCHEMBL3526413 | 0.81 | PKM (0.42) | ADORA1GSK3BGSK3A | |
| SCHEMBL3529268 | 0.81 | ADORA1 (0.37) | ADORA1GSK3BGSK3A | |
| SCHEMBL3521775 | 0.81 | GSK3B (0.36) | ADORA1GSK3BGSK3A | |
| SCHEMBL5548625 | 0.81 | ADORA1 (0.41) | 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 |