Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 7/20 | 0.56 |
| ▸ | GSK3A | P49840 | 2/20 | 0.56 |
| ▸ | AURKA | O14965 | 11/20 | 0.47 |
| ▸ | SRC | P12931 | 7/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 6/20 | 0.47 |
| ▸ | PLK4 | O00444 | 3/20 | 0.47 |
| ▸ | PAK4 | O96013 | 3/20 | 0.47 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | EIF2AK2 | P19525 | 2/20 | 0.46 |
| ▸ | JAK2 | O60674 | 2/20 | 0.43 |
| ▸ | TYK2 | P29597 | 2/20 | 0.43 |
| ▸ | JAK3 | P52333 | 2/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.43 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.43 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 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 | |
|---|---|---|---|---|
| SCHEMBL12430658 | 0.82 | AURKA (0.72) | GSK3BGSK3AAURKASRCAURKB | |
| SCHEMBL13054899 | 0.82 | GSK3B (0.54) | GSK3BGSK3AAURKASRCAURKB | |
| SCHEMBL12431076 | 0.81 | GSK3B (0.53) | GSK3BGSK3AAURKASRCAURKB | |
| SCHEMBL13663576 | 0.78 | EIF2AK2 (0.55) | PLK4PAK4EIF2AK2JAK2JAK3 | |
| SCHEMBL12431088 | 0.77 | EIF2AK2 (0.51) | AURKASRCAURKBPLK4PAK4 | |
| SCHEMBL5485003 | 0.76 | PAK4 (0.55) | GSK3BGSK3AAURKASRCAURKB | |
| SCHEMBL958919 | 0.74 | POLB (0.51) | GSK3BSRCPLK4PAK4EIF2AK2 | |
| SCHEMBL13636054 | 0.74 | EIF2AK2 (0.51) | PLK4PAK4EIF2AK2INSRIGF1R | |
| SCHEMBL5476838 | 0.73 | AURKA (0.54) | GSK3BGSK3AAURKASRCAURKB | |
| SCHEMBL31061096 | 0.73 | AURKA (0.54) | GSK3BGSK3AAURKASRCAURKB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7625913-B2 | Pyrazole compounds useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-12-01 | — | — | US | disclosed |
| US-7625913-B2 | Pyrazole compounds useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-12-01 | — | — | US | disclosed |
| US-7531536-B2 | Pyrazole compounds useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-05-12 | — | — | US | disclosed |
| US-7531536-B2 | Pyrazole compounds useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-05-12 | — | — | US | disclosed |