Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYK2 | P29597 | 2/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | JAK1 | P23458 | 1/20 | 0.42 |
| ▸ | JAK3 | P52333 | 1/20 | 0.42 |
| ▸ | CDK6 | Q00534 | 15/20 | 0.41 |
| ▸ | CDK4 | P11802 | 14/20 | 0.41 |
| ▸ | CCND3 | P30281 | 11/20 | 0.41 |
| ▸ | CCNA2 | P20248 | 8/20 | 0.40 |
| ▸ | CDK2 | P24941 | 8/20 | 0.40 |
| ▸ | CDK1 | P06493 | 6/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 7/20 | 0.39 |
| ▸ | CCNE2 | O96020 | 5/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | CDK9 | P50750 | 2/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.39 |
| ▸ | CDK7 | P50613 | 1/20 | 0.39 |
| ▸ | CCNH | P51946 | 1/20 | 0.39 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650949 | 0.89 | CDK6 (0.45) | TYK2JAK2JAK1JAK3CDK6 | |
| SCHEMBL22650632 | 0.84 | CDK6 (0.46) | CDK6CDK4CCND3CCNA2CDK2 | |
| SCHEMBL22650869 | 0.83 | CDK6 (0.42) | TYK2JAK2JAK1JAK3CDK6 | |
| SCHEMBL22650868 | 0.80 | CDK4 (0.42) | TYK2JAK2JAK1JAK3CDK6 | |
| SCHEMBL22650867 | 0.80 | CDK6 (0.45) | CDK6CDK4CCND3CCNA2CDK2 | |
| SCHEMBL22650547 | 0.80 | CDK6 (0.43) | CDK6CDK4CCND3CCNA2CDK2 | |
| SCHEMBL22650866 | 0.79 | CDK4 (0.46) | CDK6CDK4CCND3CCNA2CDK2 | |
| SCHEMBL22650947 | 0.77 | CDK4 (0.39) | TYK2JAK2JAK1JAK3CDK6 | |
| SCHEMBL22650550 | 0.77 | CDK4 (0.42) | CDK6CDK4CCND3CCNA2CDK2 | |
| SCHEMBL22650629 | 0.77 | CDK6 (0.41) | CDK6CDK4CCND3CCNA2CDK2 |
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 |