Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AXL | P30530 | 5/20 | 0.53 |
| ▸ | NEK2 | P51955 | 1/20 | 0.46 |
| ▸ | ALK | Q9UM73 | 10/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.44 |
| ▸ | MAP4K1 | Q92918 | 3/20 | 0.42 |
| ▸ | BPTF | Q12830 | 1/20 | 0.42 |
| ▸ | INSR | P06213 | 4/20 | 0.41 |
| ▸ | BTK | Q06187 | 1/20 | 0.41 |
| ▸ | MET | P08581 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL25839009 | 0.86 | AXL (0.71) | AXLNEK2ALKAURKAAURKB | |
| SCHEMBL885317 | 0.71 | AXL (0.73) | AXLNEK2ALKAURKAAURKB | |
| SCHEMBL24072923 | 0.68 | AXL (0.76) | AXLNEK2ALKAURKAAURKB | |
| SCHEMBL24073783 | 0.68 | AXL (0.76) | AXLNEK2ALKAURKAAURKB | |
| SCHEMBL19831512 | 0.68 | ALK (0.65) | AXLALKINSRMET | |
| SCHEMBL886555 | 0.67 | AXL (0.77) | AXLNEK2ALKAURKAAURKB | |
| SCHEMBL23533823 | 0.67 | MAP4K1 (0.72) | ALKMAP4K1MET | |
| SCHEMBL31173541 | 0.67 | AXL (0.76) | AXLNEK2ALKAURKAAURKB | |
| SCHEMBL25837783 | 0.67 | AXL (0.76) | AXLNEK2ALKAURKAAURKB | |
| SCHEMBL886365 | 0.67 | AXL (0.76) | AXLNEK2ALKAURKAAURKB |
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-2023134582-A1 | PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF | 上海立森印迹医药技术有限公司 | 2023-07-20 | — | — | WO | disclosed |