Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.50 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.50 |
| ▸ | AURKA | O14965 | 5/20 | 0.47 |
| ▸ | SYK | P43405 | 4/20 | 0.47 |
| ▸ | BTK | Q06187 | 1/20 | 0.46 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.46 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.46 |
| ▸ | CDK4 | P11802 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.45 |
| ▸ | GSK3A | P49840 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | JAK3 | P52333 | 1/20 | 0.44 |
| ▸ | ITK | Q08881 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL4764815 | 0.93 | CHEK1 (0.49) | CHEK1NTRK2AURKASYKBTK | |
| SCHEMBL4771624 | 0.93 | CHEK1 (0.46) | CHEK1NTRK2AURKASYKBTK | |
| SCHEMBL4766694 | 0.91 | SYK (0.50) | CHEK1NTRK2AURKASYKBTK | |
| SCHEMBL4765275 | 0.90 | CHEK1 (0.43) | CHEK1NTRK2AURKASYKBTK | |
| SCHEMBL4775386 | 0.89 | AURKA (0.49) | NTRK2AURKASYKBTKMAPK9 | |
| SCHEMBL4770076 | 0.89 | MAPK9 (0.45) | CHEK1NTRK2BTKMAPK9CDK4 | |
| SCHEMBL4775312 | 0.89 | GAA (0.43) | CHEK1NTRK2SYKMAPK9MAPK10 | |
| SCHEMBL4765277 | 0.88 | SYK (0.44) | CHEK1NTRK2SYKBTKMAPK9 | |
| SCHEMBL4772107 | 0.87 | MAPK8 (0.57) | AURKASYKBTKMAPK9CDK4 | |
| SCHEMBL4766654 | 0.86 | CHEK1 (0.46) | CHEK1NTRK2AURKASYKBTK |
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 |