Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 4/20 | 0.45 |
| ▸ | CDK1 | P06493 | 5/20 | 0.45 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.44 |
| ▸ | CDK2 | P24941 | 3/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | EZH2 | Q15910 | 3/20 | 0.43 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.41 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 1/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
| ▸ | CCND1 | P24385 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.41 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30148817 | 0.91 | ADORA3 (0.44) | CTSLCDK1CCNE1CDK2ADORA3 | |
| SCHEMBL30148797 | 0.88 | TDP1 (0.49) | CTSLCDK1CCNE1CDK2TDP1 | |
| SCHEMBL30148787 | 0.88 | YTHDC1 (0.59) | ADORA3ADORA1ADORA2AFLT3 | |
| SCHEMBL30148802 | 0.85 | CTSL (0.46) | CTSLCDK1CCNE1CDK2ADORA3 | |
| SCHEMBL30148786 | 0.84 | CTSL (0.44) | CTSLCDK1CCNE1CDK2ADORA3 | |
| SCHEMBL30148799 | 0.84 | FLT3 (0.51) | CTSLCDK1EZH2FLT3 | |
| SCHEMBL28523974 | 0.81 | CDK1 (0.57) | CDK1CCNE1CDK2TDP1CCNB2 | |
| SCHEMBL30148782 | 0.80 | YTHDC1 (0.58) | ADORA3ADORA1ADORA2AFLT3 | |
| SCHEMBL30148811 | 0.79 | TDP1 (0.48) | CTSLCDK1CCNE1CDK2TDP1 | |
| SCHEMBL30148806 | 0.79 | CDK1 (0.45) | CDK1CCNE1CDK2ADORA3ADORA1 |
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 |