Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 14/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.47 |
| ▸ | PDE9A | O76083 | 2/20 | 0.45 |
| ▸ | SELP | P16109 | 2/20 | 0.45 |
| ▸ | TYRO3 | Q06418 | 2/20 | 0.45 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.45 |
| ▸ | IKBKB | O14920 | 1/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | PAK4 | O96013 | 1/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | INSR | P06213 | 1/20 | 0.45 |
| ▸ | LCK | P06239 | 1/20 | 0.45 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.45 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2323716 | 0.93 | PLK1 (0.47) | PLK1BRD4BRDTSELPTYRO3 | |
| SCHEMBL2396454 | 0.87 | PLK1 (0.57) | PLK1BRD4BRDTTTK | |
| SCHEMBL2396321 | 0.85 | PLK1 (0.46) | PLK1BRD4BRDTPDE9ATTK | |
| SCHEMBL524087 | 0.84 | PLK1 (0.46) | PLK1BRD4BRDTTTK | |
| SCHEMBL523913 | 0.84 | PLK1 (0.46) | PLK1BRD4BRDTTTK | |
| SCHEMBL2322536 | 0.83 | PLK1 (0.45) | PLK1BRD4BRDTTTK | |
| SCHEMBL2326641 | 0.82 | PLK1 (0.48) | PLK1BRD4BRDTTYRO3IKBKB | |
| SCHEMBL2321921 | 0.82 | PLK1 (0.45) | PLK1BRD4BRDTTYRO3TTK | |
| SCHEMBL2324091 | 0.81 | PLK1 (0.45) | PLK1BRD4BRDTTTK | |
| SCHEMBL2321132 | 0.81 | PLK1 (0.44) | PLK1BRD4BRDTTYRO3TTK |
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-2011036566-A1 | METHODS FOR PREPARING PYRIMIDINE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-03-31 | — | — | WO | disclosed |