Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK6 | Q00534 | 19/20 | 0.59 |
| ▸ | CCND1 | P24385 | 9/20 | 0.59 |
| ▸ | CCND3 | P30281 | 9/20 | 0.58 |
| ▸ | CDK4 | P11802 | 9/20 | 0.58 |
| ▸ | CCNA2 | P20248 | 6/20 | 0.58 |
| ▸ | CDK2 | P24941 | 6/20 | 0.58 |
| ▸ | CDK1 | P06493 | 5/20 | 0.58 |
| ▸ | CCNE2 | O96020 | 4/20 | 0.58 |
| ▸ | DYRK2 | Q92630 | 2/20 | 0.58 |
| ▸ | PIM1 | P11309 | 2/20 | 0.58 |
| ▸ | CIT | O14578 | 1/20 | 0.58 |
| ▸ | GAK | O14976 | 1/20 | 0.58 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.58 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.58 |
| ▸ | STK16 | O75716 | 1/20 | 0.58 |
| ▸ | CCNK | O75909 | 1/20 | 0.58 |
| ▸ | STK10 | O94804 | 1/20 | 0.58 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.58 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.58 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650614 | 0.87 | CDK6 (0.75) | CDK6CCND1CCND3CDK4CCNA2 | |
| SCHEMBL22650547 | 0.84 | CDK6 (0.43) | CDK6CCND1CCND3CDK4CCNA2 | |
| SCHEMBL22650558 | 0.82 | CDK6 (0.47) | CDK6CCND1CCND3CDK4CCNA2 | |
| SCHEMBL22650629 | 0.79 | CDK6 (0.41) | CDK6CCND1CCND3CDK4CCNA2 | |
| SCHEMBL22650768 | 0.79 | CDK6 (0.59) | CDK6CCND1CCND3CDK4CCNA2 | |
| SCHEMBL22650734 | 0.79 | CDK6 (0.48) | CDK6CCND1CCND3CDK4CCNA2 | |
| SCHEMBL22650865 | 0.78 | CDK4 (0.55) | CDK6CCND1CCND3CDK4CCNA2 | |
| SCHEMBL24322258 | 0.78 | CDK6 (0.78) | CDK6CCND1CCND3CDK4CCNA2 | |
| SCHEMBL29514974 | 0.78 | CDK6 (0.78) | CDK6CCND1CCND3CDK4CCNA2 | |
| SCHEMBL22650857 | 0.78 | CDK6 (0.45) | CDK6CCND1CCND3CDK4CCNA2 |
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 |