Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 4/20 | 0.45 |
| ▸ | CDK2 | P24941 | 10/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 8/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 8/20 | 0.38 |
| ▸ | CDK9 | P50750 | 6/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.38 |
| ▸ | CDK7 | P50613 | 2/20 | 0.38 |
| ▸ | CCNH | P51946 | 2/20 | 0.38 |
| ▸ | CCNK | O75909 | 1/20 | 0.37 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.36 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.35 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.35 |
| ▸ | CDK4 | P11802 | 2/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.35 |
| ▸ | CCNT2 | O60583 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30148821 | 0.91 | CDK1 (0.55) | CDK1CDK2CDK5CDK5R1CDK9 | |
| SCHEMBL30148812 | 0.91 | CDK1 (0.45) | CDK1CDK2CDK5CDK5R1CDK9 | |
| SCHEMBL30148806 | 0.84 | CDK1 (0.45) | CDK1CDK2CDK5CDK5R1CDK9 | |
| SCHEMBL30148780 | 0.82 | CDK1 (0.55) | CDK1CDK2CDK5CDK5R1CDK9 | |
| SCHEMBL30148786 | 0.81 | CTSL (0.44) | CDK1CDK2CCNE1ADORA3ADORA1 | |
| SCHEMBL30148794 | 0.79 | CDK1 (0.43) | CDK1CDK2CDK5CDK5R1CDK9 | |
| SCHEMBL30148792 | 0.77 | YTHDC1 (0.58) | ADORA3ADORA1ADORA2ANPC1 | |
| SCHEMBL28523974 | 0.74 | CDK1 (0.57) | CDK1CDK2CDK5CDK5R1CDK9 | |
| SCHEMBL5196618 | 0.73 | CDK1 (0.52) | CDK1CDK2CDK5CDK5R1ADORA3 | |
| SCHEMBL5192872 | 0.73 | CDK1 (0.79) | CDK1CDK2CDK5CDK5R1CDK9 |
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-110903289-B | Purine-aminomethyl-pyridone derivative, preparation method and application thereof | 四川大学 | 2023-02-03 | — | — | CN | disclosed |