Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACVR1 | Q04771 | 2/20 | 0.35 |
| ▸ | JAK2 | O60674 | 5/20 | 0.34 |
| ▸ | JAK3 | P52333 | 3/20 | 0.34 |
| ▸ | CDK2 | P24941 | 7/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | CDK1 | P06493 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.33 |
| ▸ | WEE1 | P30291 | 2/20 | 0.33 |
| ▸ | CDK4 | P11802 | 3/20 | 0.33 |
| ▸ | CDK9 | P50750 | 3/20 | 0.33 |
| ▸ | AURKA | O14965 | 2/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | CDC7 | O00311 | 1/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | CIT | O14578 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650576 | 0.92 | CDK6 (0.38) | CDK2CDK1CCNB1CCNA2CCNA1 | |
| SCHEMBL22650624 | 0.90 | EGFR (0.34) | EGFRCDK6 | |
| SCHEMBL22650618 | 0.89 | TTK (0.33) | MAPK1CDK4EGFRTTKCDK6 | |
| SCHEMBL22650626 | 0.82 | CDK2 (0.39) | ACVR1JAK2JAK3CDK2KCNH2 | |
| SCHEMBL22650513 | 0.81 | CDK4 (0.36) | CDK2CDK1CCNB1CCNA2CCNA1 | |
| SCHEMBL22650781 | 0.81 | IKBKB (0.39) | JAK2JAK3CDK2KCNH2CDK1 | |
| SCHEMBL22650630 | 0.81 | CDK9 (0.35) | JAK2JAK3CDK2KCNH2CDK1 | |
| SCHEMBL22650620 | 0.79 | CDK2 (0.36) | JAK2JAK3CDK2KCNH2CDK1 | |
| SCHEMBL22650578 | 0.79 | IKBKB (0.35) | JAK2JAK3CDK2KCNH2CDK1 | |
| SCHEMBL22650537 | 0.77 | CDK2 (0.50) | JAK2CDK2CDK1CCNB1CCNA2 |
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 |