Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 17/20 | 0.49 |
| ▸ | GSK3B | P49841 | 17/20 | 0.49 |
| ▸ | CDK1 | P06493 | 16/20 | 0.49 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.49 |
| ▸ | CDK2 | P24941 | 3/20 | 0.49 |
| ▸ | AURKA | O14965 | 2/20 | 0.49 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.49 |
| ▸ | PAK4 | O96013 | 2/20 | 0.49 |
| ▸ | ABL1 | P00519 | 2/20 | 0.49 |
| ▸ | FYN | P06241 | 2/20 | 0.49 |
| ▸ | RET | P07949 | 2/20 | 0.49 |
| ▸ | KDR | P35968 | 2/20 | 0.49 |
| ▸ | CDK8 | P49336 | 2/20 | 0.49 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.49 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.49 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.49 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.49 |
| ▸ | CDC7 | O00311 | 1/20 | 0.49 |
| ▸ | PLK4 | O00444 | 1/20 | 0.49 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL1779142 | 1.00 | GSK3A (0.49) | GSK3AGSK3BCDK1MAPK8CDK2 | |
| SCHEMBL1779140 | 1.00 | GSK3A (0.49) | GSK3AGSK3BCDK1MAPK8CDK2 | |
| SCHEMBL1777171 | 0.79 | GSK3A (0.68) | GSK3AGSK3BCDK1MAPK8CDK2 | |
| SCHEMBL12205754 | 0.75 | GSK3A (0.82) | GSK3AGSK3BCDK1MAPK8CDK2 | |
| SCHEMBL3100624 | 0.74 | GSK3A (0.70) | GSK3AGSK3BCDK1MAPK8CDK2 | |
| SCHEMBL1777968 | 0.73 | GSK3A (0.53) | GSK3AGSK3BCDK1MAPK8CDK2 | |
| Iodide SCHEMBL5618949 | 0.71 | GSK3A (0.60) | GSK3AGSK3BCDK1MAPK8CDK2 | |
| SCHEMBL1777265 | 0.70 | GSK3A (0.56) | GSK3AGSK3BCDK1MAPK8CDK2 | |
| SCHEMBL1777803 | 0.70 | GSK3A (0.55) | GSK3AGSK3BCDK1MAPK8CDK2 | |
| SCHEMBL1778992 | 0.70 | GSK3A (0.62) | GSK3AGSK3BCDK1MAPK8CDK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7943616-B2 | Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders | AVENTIS PHARMACEUTICALS INC. (US) | 2011-05-17 | — | — | US | disclosed |
| EP-2233486-A1 | Azaindoles | Aventis Pharma Limited (GB) | 2010-09-29 | — | — | EP | disclosed |