Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 7/20 | 0.45 |
| ▸ | GSK3A | P49840 | 5/20 | 0.45 |
| ▸ | AURKA | O14965 | 5/20 | 0.44 |
| ▸ | EGFR | P00533 | 5/20 | 0.43 |
| ▸ | JAK3 | P52333 | 2/20 | 0.43 |
| ▸ | ITK | Q08881 | 3/20 | 0.43 |
| ▸ | SYK | P43405 | 2/20 | 0.43 |
| ▸ | IGF1R | P08069 | 2/20 | 0.43 |
| ▸ | JAK2 | O60674 | 2/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.43 |
| ▸ | BTK | Q06187 | 2/20 | 0.43 |
| ▸ | PLK4 | O00444 | 1/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.43 |
| ▸ | INSR | P06213 | 1/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | CDK1 | P06493 | 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 | |
|---|---|---|---|---|
| SCHEMBL4775386 | 0.92 | AURKA (0.49) | GSK3BGSK3AAURKAEGFRJAK3 | |
| SCHEMBL4772172 | 0.90 | GSK3B (0.51) | GSK3BGSK3AAURKAEGFRJAK3 | |
| SCHEMBL4771780 | 0.88 | EGFR (0.46) | GSK3BGSK3AAURKAEGFRJAK3 | |
| SCHEMBL4774864 | 0.82 | CHEK1 (0.50) | GSK3BGSK3AAURKAEGFRJAK3 | |
| SCHEMBL4774405 | 0.81 | GSK3B (0.48) | GSK3BGSK3AAURKAEGFRJAK3 | |
| SCHEMBL4766694 | 0.81 | SYK (0.50) | AURKAEGFRJAK3ITKSYK | |
| SCHEMBL4769925 | 0.81 | AURKA (0.48) | GSK3BGSK3AAURKAEGFRJAK3 | |
| SCHEMBL4775316 | 0.80 | JAK2 (0.46) | GSK3BGSK3AAURKAEGFRJAK3 | |
| SCHEMBL4764831 | 0.80 | EGFR (0.51) | GSK3BGSK3AAURKAEGFRJAK3 | |
| SCHEMBL4772107 | 0.79 | MAPK8 (0.57) | AURKAEGFRJAK3ITKSYK |
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-1581531-B1 | PYRIDINO¬2,3-D PYRIMIDINE DERIVATIVES AS SELECTIIVE KDR AND FGFR INHIBITORS | HOFFMANN LA ROCHE (CH) | 2008-02-27 | — | — | EP | claimed |