Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPYD | Q12882 | 1/20 | 0.38 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.33 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 5/20 | 0.31 |
| ▸ | FASN | P49327 | 4/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
| ▸ | PNP | P00491 | 1/20 | 0.30 |
| ▸ | TYMP | P19971 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25814975 | 0.79 | IDH1 (0.39) | IDH1CSNK2A2CSNK2BCSNK2A1PNP | |
| SCHEMBL16637455 | 0.76 | IDH1 (0.36) | IDH1CSNK2A2CSNK2BCSNK2A1DAO | |
| SCHEMBL21379214 | 0.76 | IDH1 (0.36) | DPYDIDH1CSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL29592452 | 0.76 | IDH1 (0.36) | DPYDIDH1CSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL29388927 | 0.76 | IDH1 (0.36) | IDH1CSNK2A2CSNK2BCSNK2A1DAO | |
| SCHEMBL24004705 | 0.74 | GRIN2D (0.38) | IDH1CSNK2A2CSNK2BCSNK2A1PNP | |
| SCHEMBL31542506 | 0.74 | IDH1 (0.34) | IDH1CSNK2A2CSNK2BCSNK2A1PNP | |
| SCHEMBL25330088 | 0.72 | SIRT2 (0.41) | TYMP | |
| SCHEMBL30504352 | 0.70 | PGR (0.37) | IDH1CSNK2A2CSNK2BCSNK2A1CHEK1 | |
| SCHEMBL22393852 | 0.70 | PGR (0.37) | IDH1CSNK2A2CSNK2BCSNK2A1CHEK1 |
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-2023125989-A1 | QUINAZOLINE COMPOUND AND APPLICATION THEREOF | 上海医药集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |