Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK6 | Q00534 | 5/20 | 0.35 |
| ▸ | CDK4 | P11802 | 4/20 | 0.35 |
| ▸ | CDK1 | P06493 | 2/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | CCND1 | P24385 | 1/20 | 0.35 |
| ▸ | CSF1R | P07333 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 2/20 | 0.34 |
| ▸ | MAP3K14 | Q99558 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.33 |
| ▸ | MAPK3 | P27361 | 3/20 | 0.33 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.32 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.32 |
| ▸ | CAMKK2 | Q96RR4 | 2/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | CHUK | O15111 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | CCND3 | P30281 | 2/20 | 0.32 |
| ▸ | EGFR | P00533 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650524 | 0.90 | CDK6 (0.38) | CDK6CDK4CDK1CCNB1CCND1 | |
| SCHEMBL22650426 | 0.88 | IKBKB (0.42) | CDK6CDK4CDK1CCNB1CCND1 | |
| SCHEMBL22650937 | 0.86 | CDK4 (0.40) | CDK6CDK4CDK1CCNB1CCND1 | |
| SCHEMBL22650526 | 0.84 | MAP4K1 (0.44) | CDK6CDK4CDK1CCNB1CCND1 | |
| SCHEMBL22650430 | 0.83 | MYLK4 (0.43) | CDK6CDK4CDK1CCNB1CCND1 | |
| SCHEMBL29491175 | 0.83 | CDK4 (0.49) | CDK6CDK4CDK1CCNB1CCND1 | |
| SCHEMBL22650568 | 0.83 | CDK4 (0.49) | CDK6CDK4CDK1CCNB1CCND1 | |
| SCHEMBL22650939 | 0.82 | CAMK2D (0.44) | CDK6CDK4CDK1CCNB1CCND1 | |
| SCHEMBL22650485 | 0.79 | CDK4 (0.47) | CDK6CDK4CDK1CCNB1CCND1 | |
| SCHEMBL22650922 | 0.78 | F10 (0.38) | MAP3K14MAPK8EGFR |
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-2020224568-A1 | CDK INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2020-11-12 | — | — | WO | disclosed |