Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.38 |
| ▸ | TTK | P33981 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 9/20 | 0.38 |
| ▸ | CCND1 | P24385 | 7/20 | 0.38 |
| ▸ | CDK2 | P24941 | 6/20 | 0.38 |
| ▸ | CDK6 | Q00534 | 6/20 | 0.38 |
| ▸ | CCND3 | P30281 | 5/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.36 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.35 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 3/20 | 0.35 |
| ▸ | JAK3 | P52333 | 2/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | INSR | P06213 | 1/20 | 0.34 |
| ▸ | IGF1R | P08069 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650514 | 0.94 | CDK4 (0.38) | CDK4CCND1CDK2CDK6CCND3 | |
| SCHEMBL22650590 | 0.91 | CDK4 (0.35) | EGFRCDK4CCND1CDK2CDK6 | |
| SCHEMBL22650859 | 0.84 | CDK4 (0.51) | CDK4CCND1CDK2CDK6CCND3 | |
| SCHEMBL22650546 | 0.82 | CDK4 (0.42) | CDK4CCND1CDK2CDK6CCND3 | |
| SCHEMBL22650776 | 0.82 | CDK4 (0.36) | CDK4CCND1CDK2CDK6CCND3 | |
| SCHEMBL22650513 | 0.81 | CDK4 (0.36) | CDK4CCND1CDK2CDK6CCND3 | |
| SCHEMBL22650429 | 0.81 | CCND1 (0.40) | CDK4CCND1CDK2CDK6CCND3 | |
| SCHEMBL22650520 | 0.80 | TYK2 (0.40) | CDK4CCND1CDK2CDK6CCND3 | |
| SCHEMBL22650560 | 0.79 | CCND1 (0.36) | CDK4CCND1CDK2CDK6CCND3 | |
| SCHEMBL22650615 | 0.79 | CDK4 (0.46) | TTKCDK4CCND1CDK2CDK6 |
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 |