Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR6 | P51684 | 4/20 | 0.48 |
| ▸ | CDK2 | P24941 | 14/20 | 0.48 |
| ▸ | CCNE1 | P24864 | 13/20 | 0.48 |
| ▸ | CCND1 | P24385 | 9/20 | 0.48 |
| ▸ | CDK6 | Q00534 | 9/20 | 0.48 |
| ▸ | CDK1 | P06493 | 8/20 | 0.48 |
| ▸ | CDK4 | P11802 | 8/20 | 0.48 |
| ▸ | CCNB1 | P14635 | 8/20 | 0.48 |
| ▸ | CCND3 | P30281 | 8/20 | 0.48 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.48 |
| ▸ | CDK7 | P50613 | 4/20 | 0.48 |
| ▸ | CDK9 | P50750 | 4/20 | 0.48 |
| ▸ | CCNH | P51946 | 4/20 | 0.48 |
| ▸ | MNAT1 | P51948 | 4/20 | 0.48 |
| ▸ | CCNK | O75909 | 1/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.45 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.45 |
| ▸ | IKBKB | O14920 | 2/20 | 0.43 |
| ▸ | CHUK | O15111 | 1/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22977319 | 0.83 | CDK2 (0.67) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL26944069 | 0.82 | CDK2 (0.44) | CCR6CDK2CCNE1CCND1CDK6 | |
| SCHEMBL30496639 | 0.82 | CCR6 (0.52) | CCR6CDK2CCNE1CCND1CDK6 | |
| SCHEMBL26918854 | 0.82 | CCR6 (0.52) | CCR6CDK2CCNE1CCND1CDK6 | |
| SCHEMBL22977374 | 0.82 | CCNE1 (0.57) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL29631651 | 0.82 | CCNE1 (0.65) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL22901105 | 0.82 | CCNE1 (0.65) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL26942797 | 0.80 | CDK2 (0.44) | CCR6CDK2CCNE1CCND1CDK6 | |
| SCHEMBL30449148 | 0.78 | CCNE1 (0.67) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL22900798 | 0.78 | CCNE1 (0.67) | CDK2CCNE1CCND1CDK6CDK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4289835-A1 | CDK INHIBITOR | Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) | 2023-12-13 | — | — | EP | disclosed |
| EP-4289835-A1 | CDK INHIBITOR | Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) | 2023-12-13 | — | — | EP | disclosed |
| CN-116472270-A | CDK inhibitors | 上海齐鲁制药研究中心有限公司 | 2023-07-21 | — | — | CN | disclosed |