Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 18/20 | 0.61 |
| ▸ | CCND1 | P24385 | 17/20 | 0.61 |
| ▸ | CCND3 | P30281 | 13/20 | 0.61 |
| ▸ | CDK6 | Q00534 | 9/20 | 0.61 |
| ▸ | CCND2 | P30279 | 6/20 | 0.51 |
| ▸ | CDK2 | P24941 | 4/20 | 0.50 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.50 |
| ▸ | CDK9 | P50750 | 3/20 | 0.50 |
| ▸ | CDK1 | P06493 | 1/20 | 0.50 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | FGFR1 | P11362 | 3/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.46 |
| ▸ | FGFR2 | P21802 | 3/20 | 0.46 |
| ▸ | FGFR4 | P22455 | 3/20 | 0.46 |
| ▸ | FGFR3 | P22607 | 3/20 | 0.46 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.46 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL21460208 | 0.88 | CDK4 (0.59) | CDK4CCND1CCND3CDK6CCND2 | |
| SCHEMBL29333468 | 0.87 | CDK4 (0.63) | CDK4CCND1CCND3CDK6CCND2 | |
| SCHEMBL21482571 | 0.81 | MEN1 (0.55) | CDK4CCND1CCND3CDK6CCND2 | |
| SCHEMBL31018774 | 0.80 | CDK4 (0.60) | CDK4CCND1CCND3CDK6CCND2 | |
| SCHEMBL19294159 | 0.78 | CDK4 (0.64) | CDK4CCND1CCND3CDK6CCND2 | |
| SCHEMBL28404189 | 0.77 | CDK4 (0.63) | CDK4CCND1CCND3CDK6CCND2 | |
| Pf-06842874 SCHEMBL22553485 | 0.77 | CDK4 (1.00) | CDK4CCND1CCND3CDK6 | |
| Pf-06842874 SCHEMBL22553637 | 0.77 | CDK4 (1.00) | CDK4CCND1CCND3CDK6 | |
| Pf-06842874 SCHEMBL22553598 | 0.77 | CDK4 (1.00) | CDK4CCND1CCND3CDK6 | |
| Pf-06842874 SCHEMBL22553605 | 0.77 | CDK4 (1.00) | CDK4CCND1CCND3CDK6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3556758-B1 | 1,2-DIHYDRO-1,6-NAPHTHYRIDIN-2-ONE DERIVATIVES AS CDK4/6 INHIBITORS | CSTONE PHARMACEUTICALS SUZHOU CO LTD (CN) | 2024-07-17 | — | — | EP | disclosed |
| WO-2021110122-A1 | COMBINATION THERAPY OF CDK4/6 INHIBITOR | 基石药业（苏州）有限公司 | 2021-06-10 | — | — | WO | disclosed |