Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 3/20 | 0.33 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CDK4 | P11802 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
| ▸ | CCND1 | P24385 | 1/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30322367 | 1.00 | PIK3CA (0.33) | PIK3CACCNE2CDK1CDK4CCNB1 | |
| SCHEMBL29202702 | 0.86 | PIK3CA (0.34) | PIK3CACCNE2CDK1CDK4CCNB1 | |
| SCHEMBL30770658 | 0.83 | PIK3CA (0.34) | PIK3CACCNE2CDK1CDK4CCNB1 | |
| SCHEMBL23887048 | 0.83 | PIK3CA (0.34) | PIK3CACCNE2CDK1CDK4CCNB1 | |
| SCHEMBL23887281 | 0.83 | PIK3CA (0.34) | PIK3CACCNE2CDK1CDK4CCNB1 | |
| SCHEMBL23887148 | 0.83 | PIK3CA (0.35) | PIK3CACCNE2CDK1CDK4CCNB1 | |
| SCHEMBL30307518 | 0.83 | PIK3CA (0.35) | PIK3CACCNE2CDK1CDK4CCNB1 | |
| SCHEMBL30322521 | 0.81 | PIK3CA (0.35) | PIK3CA | |
| SCHEMBL23887360 | 0.79 | PDE2A (0.40) | PIK3CA | |
| SCHEMBL23887067 | 0.76 | DDR1 (0.40) | CCNE2CDK1CDK4CCNB1CCND1 |
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-117769546-A | Allosteric ketene inhibitors of phosphoinositide 3-kinase (PI 3K) for the treatment of disease | 佩特拉制药公司 | 2024-03-26 | — | — | CN | disclosed |