Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CDK1 | P06493 | 10/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 9/20 | 0.44 |
| ▸ | CDK2 | P24941 | 9/20 | 0.44 |
| ▸ | CCNE2 | O96020 | 4/20 | 0.43 |
| ▸ | CCNB2 | O95067 | 3/20 | 0.43 |
| ▸ | CDK4 | P11802 | 3/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.43 |
| ▸ | CCND1 | P24385 | 3/20 | 0.43 |
| ▸ | CCNB3 | Q8WWL7 | 3/20 | 0.43 |
| ▸ | FLT3 | P36888 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 3/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.41 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30148779 | 0.91 | TDP1 (0.48) | TDP1CDK1CCNE1CDK2CCNE2 | |
| SCHEMBL30148797 | 0.91 | TDP1 (0.49) | TDP1CDK1CCNE1CDK2CCNE2 | |
| SCHEMBL30148817 | 0.89 | ADORA3 (0.44) | TDP1CDK1CCNE1CDK2CTSL | |
| SCHEMBL30148793 | 0.82 | TDP1 (0.50) | TDP1CDK1CCNE1CDK2CCNE2 | |
| SCHEMBL30148791 | 0.82 | CDK2 (0.49) | TDP1CDK1CCNE1CDK2CCNE2 | |
| SCHEMBL30148786 | 0.80 | CTSL (0.44) | TDP1CDK1CCNE1CDK2CTSL | |
| SCHEMBL30148823 | 0.79 | CTSL (0.45) | TDP1CDK1CCNE1CDK2CCNE2 | |
| SCHEMBL30148782 | 0.77 | YTHDC1 (0.58) | FLT3 | |
| SCHEMBL30148799 | 0.75 | FLT3 (0.51) | CDK1FLT3CTSL | |
| SCHEMBL30148790 | 0.72 | KDM4E (0.50) | TDP1CDK1CCNE1CDK2CCNE2 |
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 |