Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 20/20 | 0.92 |
| ▸ | CDK2 | P24941 | 18/20 | 0.92 |
| ▸ | CDK6 | Q00534 | 18/20 | 0.92 |
| ▸ | CDK1 | P06493 | 9/20 | 0.92 |
| ▸ | CDK7 | P50613 | 6/20 | 0.92 |
| ▸ | CDK9 | P50750 | 6/20 | 0.92 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.85 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.85 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.82 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.82 |
| ▸ | CCND3 | P30281 | 2/20 | 0.82 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.82 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.82 |
| ▸ | JAK2 | O60674 | 1/20 | 0.82 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.82 |
| ▸ | EGFR | P00533 | 1/20 | 0.82 |
| ▸ | RAF1 | P04049 | 1/20 | 0.82 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.82 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.82 |
| ▸ | SRC | P12931 | 1/20 | 0.82 |
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 | |
|---|---|---|---|---|
| SCHEMBL17477267 | 0.96 | CDK4 (1.00) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL17485310 | 0.92 | CDK4 (1.00) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL19089098 | 0.92 | CDK4 (0.91) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL19089283 | 0.91 | CDK4 (0.86) | CDK4CDK2CDK6CDK1CDK7 | |
| Hydrochloric Acid SCHEMBL20548753 | 0.91 | CDK4 (0.90) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL19089288 | 0.91 | CDK4 (0.86) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL19089009 | 0.91 | CDK4 (1.00) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL17477262 | 0.90 | CDK4 (1.00) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL22280791 | 0.90 | CDK4 (0.89) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL22280579 | 0.90 | CDK4 (0.85) | CDK4CDK2CDK6CDK1CDK7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016015604-A1 | COMPOUNDS AS CDK SMALL-MOLECULE INHIBITORS AND USES THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-02-04 | — | — | WO | disclosed |
| WO-2016015604-A1 | COMPOUNDS AS CDK SMALL-MOLECULE INHIBITORS AND USES THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-02-04 | — | — | WO | disclosed |