Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 15/20 | 0.32 |
| ▸ | CDK6 | Q00534 | 12/20 | 0.32 |
| ▸ | CDK2 | P24941 | 6/20 | 0.32 |
| ▸ | CCND3 | P30281 | 9/20 | 0.32 |
| ▸ | CDK1 | P06493 | 6/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.32 |
| ▸ | KDR | P35968 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CDK7 | P50613 | 3/20 | 0.31 |
| ▸ | CDK9 | P50750 | 3/20 | 0.31 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.31 |
| ▸ | CCND1 | P24385 | 7/20 | 0.30 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.30 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.30 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.30 |
| ▸ | CIT | O14578 | 1/20 | 0.30 |
| ▸ | GAK | O14976 | 1/20 | 0.30 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.30 |
| ▸ | CCNT1 | O60563 | 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 | |
|---|---|---|---|---|
| SCHEMBL30309570 | 1.00 | CDK4 (0.32) | CDK4CDK6CDK2CCND3CDK1 | |
| SCHEMBL30309561 | 0.85 | RPS6KA3 (0.35) | CDK4CDK6CDK2CCND3CDK1 | |
| SCHEMBL22172159 | 0.83 | SMN1; SMN2 (0.37) | CDK4CDK6CDK2CCND3CDK1 | |
| SCHEMBL30309548 | 0.83 | SMN1; SMN2 (0.37) | CDK4CDK6CDK2CCND3CDK1 | |
| SCHEMBL24632941 | 0.75 | CDK4 (0.43) | CDK4CDK6CDK2CCND3CDK1 | |
| SCHEMBL29669654 | 0.74 | CDK4 (0.55) | CDK4CDK6CDK2CCND3CDK1 | |
| SCHEMBL2514899 | 0.74 | CDK4 (0.55) | CDK4CDK6CDK2CCND3CDK1 | |
| SCHEMBL29939081 | 0.72 | CDK4 (0.41) | CDK4CDK6CDK2CCND3CDK1 | |
| SCHEMBL29212038 | 0.72 | BRD4 (0.42) | CDK4CDK6CDK2CCNA2SMN1; SMN2 | |
| SCHEMBL30874696 | 0.72 | BRD4 (0.42) | CDK4CDK6CDK2CCNA2SMN1; SMN2 |
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-2020135507-A1 | POLYSUBSTITUTED ANILINOPYRIMIDINE DERIVATIVE AND PREPARATION METHOD AND APPLICATION THEREOF | 杭州百新生物医药科技有限公司 | 2020-07-02 | — | — | WO | disclosed |