Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 20/20 | 0.65 |
| ▸ | CCNE1 | P24864 | 17/20 | 0.65 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.55 |
| ▸ | CCNA1 | P78396 | 4/20 | 0.55 |
| ▸ | AURKA | O14965 | 2/20 | 0.52 |
| ▸ | CDK1 | P06493 | 7/20 | 0.50 |
| ▸ | CCNB1 | P14635 | 7/20 | 0.50 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.50 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.50 |
| ▸ | CCNE2 | O96020 | 4/20 | 0.50 |
| ▸ | CCNB2 | O95067 | 3/20 | 0.50 |
| ▸ | CCNB3 | Q8WWL7 | 3/20 | 0.50 |
| ▸ | CDK4 | P11802 | 4/20 | 0.49 |
| ▸ | CCND1 | P24385 | 4/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
| ▸ | CCND3 | P30281 | 3/20 | 0.47 |
| ▸ | CDK6 | Q00534 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL22612611 | 0.85 | CDK2 (0.74) | CDK2CCNE1CCNA2CCNA1AURKA | |
| SCHEMBL22612604 | 0.79 | CDK2 (1.00) | CDK2CCNE1CCNA2CCNA1AURKA | |
| SCHEMBL22612650 | 0.79 | CDK2 (0.67) | CDK2CCNE1CCNA2CCNA1AURKA | |
| SCHEMBL22612600 | 0.79 | CDK2 (0.64) | CDK2CCNE1CCNA2CCNA1AURKA | |
| SCHEMBL24474562 | 0.78 | CDK2 (0.63) | CDK2CCNE1CCNA2CCNA1AURKA | |
| SCHEMBL29683327 | 0.78 | CDK2 (0.63) | CDK2CCNE1CCNA2CCNA1AURKA | |
| SCHEMBL22612649 | 0.77 | CDK2 (0.63) | CDK2CCNE1CCNA2CCNA1AURKA | |
| SCHEMBL22612632 | 0.77 | CDK2 (0.62) | CDK2CCNE1CCNA2CCNA1AURKA | |
| SCHEMBL22612641 | 0.77 | CDK2 (0.66) | CDK2CCNE1CCNA2CCNA1AURKA | |
| SCHEMBL22612615 | 0.77 | CDK2 (0.64) | CDK2CCNE1CCNA2CCNA1AURKA |
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-2020223469-A1 | N-(1-(METHYLSULFONYL)PIPERIDIN-4-YL)-4,5-DI HYDRO-1H-IMIDAZO[4,5-H]QUINAZOLIN-8-AMINE DERIVATIVES AND RELATED COMPOUNDS AS CYCLIN-DEPENDENT KINASE 2 (CDK2) INHIBITORS FOR TREATING CANCER | INCYTE CORPORATION (US) | 2020-11-05 | — | — | WO | disclosed |