Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 11/20 | 0.37 |
| ▸ | CCND1 | P24385 | 11/20 | 0.37 |
| ▸ | CCND3 | P30281 | 10/20 | 0.37 |
| ▸ | CDK6 | Q00534 | 10/20 | 0.37 |
| ▸ | CDK2 | P24941 | 16/20 | 0.36 |
| ▸ | CCNE1 | P24864 | 8/20 | 0.36 |
| ▸ | CDK1 | P06493 | 7/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 6/20 | 0.36 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.36 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 7/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 5/20 | 0.34 |
| ▸ | CDK9 | P50750 | 5/20 | 0.34 |
| ▸ | CDK7 | P50613 | 4/20 | 0.34 |
| ▸ | CCNH | P51946 | 4/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29754832 | 0.88 | CDK2 (0.51) | CDK4CCND1CCND3CDK6CDK2 | |
| SCHEMBL24676505 | 0.88 | CDK2 (0.51) | CDK4CCND1CCND3CDK6CDK2 | |
| SCHEMBL24676838 | 0.85 | CDK2 (0.39) | CDK4CCND1CCND3CDK6CDK2 | |
| SCHEMBL24676984 | 0.83 | CDK2 (0.38) | CDK4CCND1CCND3CDK6CDK2 | |
| SCHEMBL24676669 | 0.81 | CDK4 (0.40) | CDK4CCND1CCND3CDK6CDK2 | |
| SCHEMBL24676911 | 0.81 | CDK4 (0.38) | CDK4CCND1CCND3CDK6CDK2 | |
| SCHEMBL24676008 | 0.81 | CDK4 (0.42) | CDK4CCND1CCND3CDK6CDK2 | |
| SCHEMBL24676534 | 0.80 | CCND1 (0.38) | CDK4CCND1CCND3CDK6CDK2 | |
| SCHEMBL24675974 | 0.79 | CDK4 (0.38) | CDK4CCND1CCND3CDK6CDK2 | |
| SCHEMBL24676964 | 0.79 | CCND1 (0.38) | CDK4CCND1CCND3CDK6CDK2 |
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-2022155941-A1 | CDK2 INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2022-07-28 | — | — | WO | disclosed |