Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK6 | Q00534 | 16/20 | 0.58 |
| ▸ | CDK4 | P11802 | 15/20 | 0.58 |
| ▸ | CCND3 | P30281 | 8/20 | 0.51 |
| ▸ | CCNA2 | P20248 | 5/20 | 0.47 |
| ▸ | CDK1 | P06493 | 4/20 | 0.47 |
| ▸ | CCND1 | P24385 | 9/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.44 |
| ▸ | CDK7 | P50613 | 2/20 | 0.44 |
| ▸ | CDK9 | P50750 | 2/20 | 0.44 |
| ▸ | CCNH | P51946 | 2/20 | 0.44 |
| ▸ | MNAT1 | P51948 | 2/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.44 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 4/20 | 0.43 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.43 |
| ▸ | PIM1 | P11309 | 2/20 | 0.43 |
| ▸ | CSF1R | P07333 | 2/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
| ▸ | TYK2 | P29597 | 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 | |
|---|---|---|---|---|
| SCHEMBL22650509 | 0.87 | CDK6 (0.48) | CDK6CDK4CCND3CCNA2CDK1 | |
| SCHEMBL22650772 | 0.86 | CDK6 (0.46) | CDK6CDK4CCND3CCNA2CDK1 | |
| SCHEMBL22650773 | 0.83 | CDK4 (0.45) | CDK6CDK4CCND3CCNA2CDK1 | |
| SCHEMBL29462408 | 0.81 | DYRK2 (0.47) | CDK6CDK4CCND3CCNA2CDK1 | |
| SCHEMBL22650497 | 0.81 | DYRK2 (0.47) | CDK6CDK4CCND3CCNA2CDK1 | |
| SCHEMBL22650507 | 0.80 | CDK6 (0.45) | CDK6CDK4CCND3CCNA2CDK1 | |
| SCHEMBL22650771 | 0.79 | CDK6 (0.43) | CDK6CDK4CCND3CCNA2CDK1 | |
| SCHEMBL21245745 | 0.74 | CDK4 (1.00) | CDK6CDK4CCNA2CDK7CDK9 | |
| SCHEMBL22650780 | 0.73 | CDK4 (0.54) | CDK6CDK4CCND3CCNA2CDK1 | |
| Hydrochloric Acid SCHEMBL28543843 | 0.73 | CDK4 (0.99) | CDK6CDK4CCNA2CDK7CDK9 |
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-2020224568-A1 | CDK INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2020-11-12 | — | — | WO | disclosed |