Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 16/20 | 0.74 |
| ▸ | CDK2 | P24941 | 4/20 | 0.73 |
| ▸ | CDK1 | P06493 | 4/20 | 0.70 |
| ▸ | CCND3 | P30281 | 3/20 | 0.69 |
| ▸ | GAK | O14976 | 1/20 | 0.69 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.69 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.69 |
| ▸ | FECH | P22830 | 1/20 | 0.69 |
| ▸ | CCND1 | P24385 | 1/20 | 0.69 |
| ▸ | CDK9 | P50750 | 1/20 | 0.69 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.69 |
| ▸ | CDK16 | Q00536 | 1/20 | 0.69 |
| ▸ | MAP3K1 | Q13233 | 1/20 | 0.69 |
| ▸ | CAMK2G | Q13555 | 1/20 | 0.69 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.69 |
| ▸ | Q6ZSR9 | Q6ZSR9 | 1/20 | 0.69 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.69 |
| ▸ | SIK2 | Q9H0K1 | 1/20 | 0.69 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL31728206 | 0.96 | CDK4 (0.77) | CDK4CDK2CDK1CCND3GAK | |
| SCHEMBL28922261 | 0.95 | CDK4 (0.73) | CDK4CDK2CDK1CCND3GAK | |
| SCHEMBL29639522 | 0.95 | CDK2 (0.80) | CDK4CDK2CDK1CCND3GAK | |
| SCHEMBL2298262 | 0.95 | CDK2 (0.80) | CDK4CDK2CDK1CCND3GAK | |
| SCHEMBL28620311 | 0.94 | CDK4 (0.76) | CDK4CDK2CDK1CCND3GAK | |
| SCHEMBL30643564 | 0.94 | CDK4 (0.80) | CDK4CDK2CDK1CCND3GAK | |
| SCHEMBL1992896 | 0.94 | CDK2 (0.78) | CDK4CDK2CDK1CCND3GAK | |
| SCHEMBL28637169 | 0.93 | CDK4 (0.74) | CDK4CDK2CDK1CCND3GAK | |
| SCHEMBL28636286 | 0.93 | CDK4 (0.74) | CDK4CDK2CDK1CCND3GAK | |
| SCHEMBL26641432 | 0.92 | CDK2 (0.75) | CDK4CDK2CDK1CCND3GAK |
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 |
|---|---|---|---|---|---|---|---|
| CN-113387931-A | Compound capable of inhibiting or degrading protein kinase, preparation method and pharmaceutical application thereof | 四川海思科制药有限公司 | 2021-09-14 | — | — | CN | disclosed |