Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 10/20 | 0.59 |
| ▸ | CCNE2 | O96020 | 5/20 | 0.59 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.59 |
| ▸ | CDK1 | P06493 | 5/20 | 0.59 |
| ▸ | CCNB2 | O95067 | 4/20 | 0.59 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.59 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.59 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.59 |
| ▸ | CCNB3 | Q8WWL7 | 4/20 | 0.59 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.59 |
| ▸ | CDK9 | P50750 | 4/20 | 0.59 |
| ▸ | CDK4 | P11802 | 4/20 | 0.52 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.52 |
| ▸ | CDK6 | Q00534 | 3/20 | 0.52 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | IKBKB | O14920 | 2/20 | 0.42 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.42 |
| ▸ | STK4 | Q13043 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650482 | 0.93 | CDK1 (0.59) | CDK2CCNE2CCNE1CDK1CCNB2 | |
| SCHEMBL22650918 | 0.84 | DKK1 (0.57) | CDK2CDK1CCNB1CCNT1CDK9 | |
| SCHEMBL22650401 | 0.79 | NTRK1 (0.46) | CDK2CDK4CCNA2CDK6 | |
| SCHEMBL22650396 | 0.76 | CDK6 (0.47) | CDK2CCNE1CDK5CDK5R1CDK9 | |
| SCHEMBL22650944 | 0.76 | CDK2 (0.61) | CDK2CCNE2CCNE1CDK1CCNB2 | |
| SCHEMBL22650740 | 0.75 | RPS6KA5 (0.32) | — | |
| SCHEMBL31590790 | 0.74 | CDK6 (0.42) | CDK2CCNE1CDK1CCNB1CDK5 | |
| SCHEMBL22650406 | 0.74 | CDK6 (0.44) | CDK2CCNE1CDK5CDK5R1CDK9 | |
| SCHEMBL22650475 | 0.72 | CDK6 (0.58) | CDK2CCNE1CDK1CCNB1CDK5 | |
| SCHEMBL22650392 | 0.71 | CDK6 (0.64) | CDK2CCNE2CCNE1CDK1CCNB1 |
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 |