Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 6/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 5/20 | 0.46 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.46 |
| ▸ | CDK9 | P50750 | 3/20 | 0.46 |
| ▸ | JAK2 | O60674 | 3/20 | 0.46 |
| ▸ | DAPK3 | O43293 | 2/20 | 0.46 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.46 |
| ▸ | PAK4 | O96013 | 2/20 | 0.46 |
| ▸ | PIM1 | P11309 | 2/20 | 0.46 |
| ▸ | CSNK1A1 | P48729 | 2/20 | 0.46 |
| ▸ | CLK2 | P49760 | 2/20 | 0.46 |
| ▸ | GSK3A | P49840 | 2/20 | 0.46 |
| ▸ | GSK3B | P49841 | 2/20 | 0.46 |
| ▸ | MAP4K2 | Q12851 | 2/20 | 0.46 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.46 |
| ▸ | KDR | P35968 | 2/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | RET | P07949 | 1/20 | 0.46 |
| ▸ | IGF1R | P08069 | 1/20 | 0.46 |
| ▸ | MET | P08581 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29538181 | 1.00 | AURKA (0.46) | AURKAAURKBALKCDK9JAK2 | |
| SCHEMBL29537810 | 0.88 | ALK (0.46) | AURKAAURKBALKCDK9JAK2 | |
| SCHEMBL29537921 | 0.85 | ABL1 (0.49) | AURKAAURKBALKCDK9JAK2 | |
| SCHEMBL30584595 | 0.83 | CDK2 (0.61) | AURKAAURKBCDK9GSK3BABL1 | |
| SCHEMBL29250751 | 0.83 | CDK2 (0.61) | AURKAAURKBCDK9GSK3BABL1 | |
| SCHEMBL24392832 | 0.83 | ALK (0.49) | AURKAAURKBALKCDK9JAK2 | |
| SCHEMBL30584598 | 0.83 | ALK (0.49) | AURKAAURKBALKCDK9JAK2 | |
| SCHEMBL24392726 | 0.77 | JAK3 (0.60) | JAK2JAK3MAP2K1BTKMAPK1 | |
| SCHEMBL16513405 | 0.77 | CDK19 (0.56) | AURKAAURKBALKCDK9JAK2 | |
| SCHEMBL29538295 | 0.77 | ALK (0.56) | AURKAAURKBALKCDK9JAK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116685583-A | Pyrimidine compounds, compositions and pharmaceutical uses thereof | 缆图药品公司 | 2023-09-01 | — | — | CN | disclosed |