Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 17/20 | 0.60 |
| ▸ | CCNE2 | O96020 | 12/20 | 0.60 |
| ▸ | CCNE1 | P24864 | 12/20 | 0.60 |
| ▸ | CDK2 | P24941 | 12/20 | 0.60 |
| ▸ | GSK3A | P49840 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5219446 | 0.91 | GSK3B (0.51) | GSK3BCCNE2CCNE1CDK2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5221093 | 0.87 | GSK3B (0.77) | GSK3BCCNE2CCNE1CDK2GSK3A | |
| Hydrochloric Acid SCHEMBL5219189 | 0.86 | GSK3B (0.58) | GSK3BCCNE2CCNE1CDK2GSK3A | |
| Hydrochloric Acid SCHEMBL5224554 | 0.86 | GSK3B (0.61) | GSK3BCCNE2CCNE1CDK2GSK3A | |
| Hydrochloric Acid SCHEMBL5223613 | 0.86 | GSK3B (0.61) | GSK3BCCNE2CCNE1CDK2GSK3A | |
| SCHEMBL3274547 | 0.86 | GSK3B (0.78) | GSK3BCCNE2CCNE1CDK2GSK3A | |
| Hydrochloric Acid SCHEMBL5224249 | 0.85 | GSK3B (0.49) | GSK3BCCNE2CCNE1CDK2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5223643 | 0.85 | GSK3B (0.61) | GSK3BCCNE2CCNE1CDK2GSK3A | |
| SCHEMBL5221380 | 0.85 | GSK3B (0.51) | GSK3BCCNE2CCNE1CDK2GSK3A | |
| Hydrochloric Acid SCHEMBL5223876 | 0.84 | CYP1A2 (0.58) | GSK3BCCNE2CCNE1CDK2GSK3A |
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-1575942-B1 | COMPOUNDS HAVING SELECTIVE INHIBITING EFECT AT GSK3 | ASTRAZENECA AB (SE) | 2007-05-02 | — | — | EP | claimed |