Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 7/20 | 0.33 |
| ▸ | CDK6 | Q00534 | 7/20 | 0.33 |
| ▸ | CCND1 | P24385 | 6/20 | 0.33 |
| ▸ | CCND3 | P30281 | 6/20 | 0.33 |
| ▸ | PDCD1 | Q15116 | 4/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 4/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | JAK1 | P23458 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650393 | 0.79 | CCNT1 (0.36) | PDCD1CD274JAK2JAK1RORC | |
| SCHEMBL29491154 | 0.79 | CCNT1 (0.36) | PDCD1CD274JAK2JAK1RORC | |
| SCHEMBL22650586 | 0.76 | EGFR (0.39) | CDK4CDK6CCND1CCND3CDK2 | |
| SCHEMBL22650358 | 0.74 | EGFR (0.33) | CDK4CDK6CCND1CCND3CDK2 | |
| SCHEMBL22650868 | 0.74 | CDK4 (0.42) | CDK4CDK6CCND1CCND3JAK2 | |
| SCHEMBL22650391 | 0.73 | JAK2 (0.32) | JAK2JAK1 | |
| SCHEMBL22650727 | 0.70 | ALDH1A1 (0.33) | ALDH1A1GAA | |
| SCHEMBL22650721 | 0.69 | SMN1; SMN2 (0.34) | CDK4CDK6CCND1CCND3CDK2 | |
| SCHEMBL22650400 | 0.67 | CCNT1 (0.39) | CDK6CCND1JAK2JAK1CDK2 | |
| SCHEMBL29491148 | 0.67 | CCNT1 (0.39) | CDK6CCND1JAK2JAK1CDK2 |
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 |