Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 19/20 | 0.69 |
| ▸ | CDK6 | Q00534 | 19/20 | 0.69 |
| ▸ | CCND1 | P24385 | 18/20 | 0.69 |
| ▸ | CCND3 | P30281 | 18/20 | 0.69 |
| ▸ | CCNA2 | P20248 | 17/20 | 0.69 |
| ▸ | CDK2 | P24941 | 17/20 | 0.69 |
| ▸ | CCNT1 | O60563 | 14/20 | 0.69 |
| ▸ | CDK9 | P50750 | 14/20 | 0.69 |
| ▸ | CDK7 | P50613 | 13/20 | 0.69 |
| ▸ | CCNH | P51946 | 13/20 | 0.69 |
| ▸ | CDK1 | P06493 | 10/20 | 0.69 |
| ▸ | CCNB1 | P14635 | 10/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL20463052 | 0.82 | CDK4 (1.00) | CDK4CDK6CCND1CCND3CCNA2 | |
| SCHEMBL18453251 | 0.74 | CDK6 (1.00) | CDK4CDK6CCND1CCND3CCNA2 | |
| SCHEMBL18481294 | 0.74 | CDK4 (1.00) | CDK4CDK6CCND1CCND3CCNA2 | |
| SCHEMBL29815954 | 0.74 | CDK6 (1.00) | CDK4CDK6CCND1CCND3CCNA2 | |
| SCHEMBL29815364 | 0.73 | CDK4 (0.84) | CDK4CDK6CCND1CCND3CCNA2 | |
| SCHEMBL20452117 | 0.73 | CDK4 (0.84) | CDK4CDK6CCND1CCND3CCNA2 | |
| SCHEMBL18453323 | 0.73 | CDK4 (1.00) | CDK4CDK6CCND1CCND3CCNA2 | |
| SCHEMBL29815852 | 0.73 | CDK4 (1.00) | CDK4CDK6CCND1CCND3CCNA2 | |
| SCHEMBL20463054 | 0.73 | CDK4 (1.00) | CDK4CDK6CCND1CCND3CCNA2 | |
| SCHEMBL20452088 | 0.73 | CDK4 (1.00) | CDK4CDK6CCND1CCND3CCNA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017020065-A1 | N-(PYRIDIN-2-YL)-4-(THIAZOL-5-YL)PYRIMIDIN-2-AMINE DERIVATIVES AS THERAPEUTIC COMPOUNDS | UNIVERSITY OF SOUTH AUSTRALIA (AU) | 2017-02-09 | — | — | WO | disclosed |