Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 18/20 | 0.45 |
| ▸ | CCNE1 | P24864 | 16/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 4/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3137443 | 1.00 | CDK2 (0.45) | CDK2CCNE1MAPK1GSK3BP2RX7 | |
| SCHEMBL3567391 | 0.94 | CDK2 (0.48) | CDK2CCNE1GSK3B | |
| SCHEMBL3567389 | 0.94 | CDK2 (0.48) | CDK2CCNE1GSK3B | |
| SCHEMBL3133077 | 0.85 | CCNE1 (0.48) | CDK2CCNE1GSK3B | |
| SCHEMBL3133072 | 0.85 | CCNE1 (0.48) | CDK2CCNE1GSK3B | |
| SCHEMBL3127512 | 0.83 | CCNE1 (0.47) | CDK2CCNE1GSK3B | |
| SCHEMBL3127523 | 0.83 | CCNE1 (0.47) | CDK2CCNE1GSK3B | |
| SCHEMBL3127532 | 0.83 | CCNE1 (0.47) | CDK2CCNE1GSK3B | |
| SCHEMBL3126992 | 0.83 | CDK13 (0.49) | CDK2CCNE1GSK3B | |
| SCHEMBL3126989 | 0.83 | CDK13 (0.49) | CDK2CCNE1GSK3B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1689721-B1 | AMINOPYRAZOLE DERIVATIVES AS GSK-3 INHIBITORS | PFIZER PROD INC (US) | 2010-07-14 | — | — | EP | claimed |
| US-7671072-B2 | Aminopyrazole derivatives as GSK-3 inhibitors | PFIZER INC. (US) | 2010-03-02 | — | — | US | claimed |
| EP-1689721-B1 | AMINOPYRAZOLE DERIVATIVES AS GSK-3 INHIBITORS | PFIZER PROD INC (US) | 2010-07-14 | — | — | EP | disclosed |