Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 5/20 | 0.32 |
| ▸ | TLR9 | Q9NR96 | 4/20 | 0.32 |
| ▸ | TLR8 | Q9NR97 | 4/20 | 0.32 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | CCND1 | P24385 | 1/20 | 0.32 |
| ▸ | CCND3 | P30281 | 1/20 | 0.32 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.32 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.32 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.32 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.32 |
| ▸ | CDK1 | P06493 | 2/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.32 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.32 |
| ▸ | CDK2 | P24941 | 2/20 | 0.32 |
| ▸ | CDK9 | P50750 | 2/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30309573 | 0.86 | NTRK1 (0.40) | RPS6KA3CDC7TLR8CDK4CDK6 | |
| SCHEMBL30309436 | 0.86 | EGFR (0.39) | RPS6KA3HTTEGFRTLR7TLR9 | |
| SCHEMBL22172159 | 0.84 | SMN1; SMN2 (0.37) | HTTEGFRCDK4CCND1CCND3 | |
| SCHEMBL30309548 | 0.84 | SMN1; SMN2 (0.37) | HTTEGFRCDK4CCND1CCND3 | |
| SCHEMBL30309561 | 0.83 | RPS6KA3 (0.35) | RPS6KA3CDC7EGFRCDK4CCND1 | |
| SCHEMBL30672547 | 0.78 | VRK1 (0.40) | HTTKDM4ENSD2ALDH1A1MAPT | |
| SCHEMBL26664246 | 0.78 | VRK1 (0.40) | HTTKDM4ENSD2ALDH1A1MAPT | |
| SCHEMBL29684604 | 0.74 | RPS6KA3 (0.43) | RPS6KA3CDC7ADORA2A | |
| SCHEMBL21344922 | 0.74 | CDK6 (0.43) | CDK4CCND1CCND3CDK6CCNT1 | |
| SCHEMBL17396104 | 0.73 | KDM4E (0.44) | HTTKDM4ENSD2ALDH1A1MAPT |
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-111377907-B | Polysubstituted phenylamino pyrimidine derivative and preparation method and application thereof | 杭州百新生物医药科技有限公司 | 2023-03-28 | — | — | CN | disclosed |