Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK6 | Q00534 | 14/20 | 0.67 |
| ▸ | CDK4 | P11802 | 14/20 | 0.67 |
| ▸ | CCND1 | P24385 | 9/20 | 0.67 |
| ▸ | CCND3 | P30281 | 7/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 6/20 | 0.46 |
| ▸ | CDK1 | P06493 | 4/20 | 0.46 |
| ▸ | CDK2 | P24941 | 4/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.41 |
| ▸ | CDK9 | P50750 | 4/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.41 |
| ▸ | CCNH | P51946 | 2/20 | 0.41 |
| ▸ | CTSC | P53634 | 1/20 | 0.41 |
| ▸ | TTK | P33981 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.41 |
| ▸ | NEK10 | Q6ZWH5 | 1/20 | 0.41 |
| ▸ | ULK2 | Q8IYT8 | 1/20 | 0.41 |
| ▸ | NUAK2 | Q9H093 | 1/20 | 0.41 |
| ▸ | CCNK | O75909 | 2/20 | 0.40 |
| ▸ | CDK7 | P50613 | 1/20 | 0.40 |
| ▸ | MNAT1 | P51948 | 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 | |
|---|---|---|---|---|
| SCHEMBL22650447 | 0.83 | CDK4 (0.60) | CDK6CDK4CCND1CCND3CCNA2 | |
| SCHEMBL22650445 | 0.83 | CDK4 (0.60) | CDK6CDK4CCND1CCND3CCNA2 | |
| SCHEMBL22650555 | 0.80 | CDK6 (1.00) | CDK6CDK4CCND1CCND3CCNA2 | |
| SCHEMBL22650551 | 0.75 | CDK6 (0.52) | CDK6CDK4CCND1CCNA2CDK1 | |
| SCHEMBL22650552 | 0.75 | CDK4 (0.53) | CDK6CDK4CCND1CCND3CCNA2 | |
| SCHEMBL22650556 | 0.74 | CDK4 (0.52) | CDK6CDK4CCND1CCND3CCNA2 | |
| SCHEMBL22650544 | 0.74 | CDK4 (0.56) | CDK6CDK4CCND1CCNA2CDK1 | |
| SCHEMBL22650749 | 0.73 | CDK4 (0.54) | CDK6CDK4CCND1 | |
| SCHEMBL22650545 | 0.73 | CDK4 (0.55) | CDK6CDK4CCND1CDK1CDK2 | |
| SCHEMBL18081375 | 0.73 | CDK4 (0.65) | CDK6CDK4CCND1CCND3CCNA2 |
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 |