Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 19/20 | 0.56 |
| ▸ | CCNE1 | P24864 | 18/20 | 0.56 |
| ▸ | CCND1 | P24385 | 12/20 | 0.56 |
| ▸ | CDK6 | Q00534 | 11/20 | 0.56 |
| ▸ | CDK4 | P11802 | 9/20 | 0.56 |
| ▸ | CCNT1 | O60563 | 8/20 | 0.56 |
| ▸ | CDK9 | P50750 | 8/20 | 0.56 |
| ▸ | IKBKB | O14920 | 1/20 | 0.54 |
| ▸ | CDK1 | P06493 | 3/20 | 0.52 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.51 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.51 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.51 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.51 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.51 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.51 |
| ▸ | CCND3 | P30281 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL31538947 | 0.83 | CDK2 (0.62) | CDK2CCNE1CCND1CDK6CDK4 | |
| SCHEMBL29660556 | 0.80 | IKBKB (0.60) | CDK2CCNE1CCND1CDK6CDK4 | |
| SCHEMBL27033299 | 0.80 | CDK2 (0.55) | CDK2CCNE1CCND1CDK6CDK4 | |
| SCHEMBL30726201 | 0.80 | CDK2 (0.55) | CDK2CCNE1CCND1CDK6CDK4 | |
| SCHEMBL5002277 | 0.79 | CCNE1 (0.56) | CDK2CCNE1CCND1CDK6CDK4 | |
| SCHEMBL27061762 | 0.78 | CDK2 (0.53) | CDK2CCNE1CCND1CDK6CDK4 | |
| SCHEMBL30804785 | 0.78 | CDK2 (0.53) | CDK2CCNE1CCND1CDK6CDK4 | |
| SCHEMBL30804793 | 0.77 | CDK2 (0.58) | CDK2CCNE1CCND1CDK6CDK4 | |
| SCHEMBL27061753 | 0.77 | CDK2 (0.55) | CDK2CCNE1CCND1CDK6CDK4 | |
| SCHEMBL27358142 | 0.77 | CDK2 (0.53) | CDK2CCNE1CCND1CDK6CDK4 |
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-114394966-A | Pyridopyrimidinone CDK2/4/6 inhibitors | 辉瑞公司 | 2022-04-26 | — | — | CN | disclosed |