Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK6 | Q00534 | 18/20 | 0.64 |
| ▸ | CDK4 | P11802 | 14/20 | 0.64 |
| ▸ | CCND3 | P30281 | 13/20 | 0.64 |
| ▸ | CDK1 | P06493 | 10/20 | 0.64 |
| ▸ | CCNA2 | P20248 | 6/20 | 0.64 |
| ▸ | CCND1 | P24385 | 5/20 | 0.64 |
| ▸ | CDK2 | P24941 | 5/20 | 0.64 |
| ▸ | DYRK2 | Q92630 | 3/20 | 0.64 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.64 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.64 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.64 |
| ▸ | PIM1 | P11309 | 2/20 | 0.64 |
| ▸ | CIT | O14578 | 1/20 | 0.64 |
| ▸ | GAK | O14976 | 1/20 | 0.64 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.64 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.64 |
| ▸ | STK16 | O75716 | 1/20 | 0.64 |
| ▸ | CCNK | O75909 | 1/20 | 0.64 |
| ▸ | STK10 | O94804 | 1/20 | 0.64 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650394 | 0.89 | CDK6 (0.65) | CDK6CDK4CCND3CDK1CCNA2 | |
| SCHEMBL22650481 | 0.87 | CDK6 (0.67) | CDK6CDK4CCND3CDK1CCNA2 | |
| SCHEMBL22650397 | 0.87 | CDK6 (0.48) | CDK6CDK4CCND3CDK1CCNA2 | |
| SCHEMBL22650483 | 0.86 | CDK6 (0.56) | CDK6CDK4CCND3CDK1CCNA2 | |
| SCHEMBL22650477 | 0.86 | CDK6 (0.61) | CDK6CDK4CCND3CDK1CCNA2 | |
| SCHEMBL22650476 | 0.83 | CDK6 (0.48) | CDK6CDK4CCND3CDK1CCNA2 | |
| SCHEMBL22650602 | 0.83 | CDK6 (0.46) | CDK6CDK4CCND3CDK1CCNA2 | |
| SCHEMBL19966563 | 0.82 | CDK6 (0.68) | CDK6CDK4CCND3CDK1CCNA2 | |
| SCHEMBL20740540 | 0.81 | CDK6 (0.69) | CDK6CDK4CCND3CDK1CCNA2 | |
| SCHEMBL19966543 | 0.80 | CDK6 (0.74) | CDK6CDK4CCND3CDK1CCNA2 |
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 |