Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.55 |
| ▸ | CDK1 | P06493 | 3/20 | 0.54 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.53 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.53 |
| ▸ | AURKA | O14965 | 5/20 | 0.52 |
| ▸ | IGF1R | P08069 | 3/20 | 0.52 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.48 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | SYK | P43405 | 2/20 | 0.46 |
| ▸ | EGFR | P00533 | 2/20 | 0.45 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.45 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.45 |
| ▸ | GSK3A | P49840 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL6826345 | 1.00 | GSK3B (0.55) | GSK3BCDK1CHEK1NTRK2AURKA | |
| SCHEMBL6829248 | 0.85 | GSK3B (0.64) | GSK3BCDK1CHEK1NTRK2AURKA | |
| SCHEMBL5262926 | 0.81 | GSK3B (0.81) | GSK3BCDK1CHEK1NTRK2AURKA | |
| SCHEMBL6826392 | 0.81 | AURKA (0.67) | GSK3BCDK1AURKAIGF1RCDK2 | |
| SCHEMBL6829175 | 0.75 | SYK (0.83) | GSK3BCDK1AURKAIGF1RSYK | |
| SCHEMBL5262378 | 0.71 | GSK3B (1.00) | GSK3BCDK1CHEK1NTRK2AURKA | |
| SCHEMBL6829108 | 0.70 | CDK2 (0.64) | GSK3BCDK1CHEK1NTRK2AURKA | |
| SCHEMBL6829794 | 0.70 | CDK2 (0.64) | GSK3BCDK1CHEK1NTRK2AURKA | |
| SCHEMBL6826387 | 0.70 | CDK2 (0.64) | GSK3BCDK1CHEK1NTRK2AURKA | |
| SCHEMBL656765 | 0.70 | AURKA (1.00) | GSK3BCDK1NTRK2AURKAIGF1R |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004046118-A2 | 2-4-(DI-PHENYL-AMINO)-PYRIMIDINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS | BAYER PHARMACEUTICALS CORPORATION (US) | 2004-06-03 | — | — | WO | disclosed |