Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 2/20 | 0.35 |
| ▸ | CCND1 | P24385 | 2/20 | 0.35 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.34 |
| ▸ | NR2C2 | P49116 | 2/20 | 0.34 |
| ▸ | TAB1 | Q15750 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 8/20 | 0.33 |
| ▸ | JAK3 | P52333 | 2/20 | 0.33 |
| ▸ | FLT3 | P36888 | 4/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | TYK2 | P29597 | 1/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.33 |
| ▸ | CCND3 | P30281 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 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 | |
|---|---|---|---|---|
| SCHEMBL22650753 | 0.85 | CDK4 (0.51) | CDK4CCND1CDK6JAK2JAK3 | |
| SCHEMBL22650754 | 0.76 | CDK4 (0.51) | CDK4CCND1CDK6JAK2JAK3 | |
| SCHEMBL22650761 | 0.76 | CDK4 (0.51) | CDK4CCND1CDK6JAK2JAK3 | |
| SCHEMBL22650444 | 0.76 | CDK4 (0.50) | CDK4CCND1CDK6CCNT1CCND3 | |
| SCHEMBL22650630 | 0.73 | CDK9 (0.35) | JAK2JAK3CDK9CDK1CCNB1 | |
| SCHEMBL22650756 | 0.73 | CDK4 (0.44) | CDK4CCND1CDK6HRH4CCNT1 | |
| SCHEMBL22650765 | 0.73 | CDK4 (0.42) | CDK4CCND1CDK6CCNT1CCND3 | |
| SCHEMBL22650741 | 0.72 | CDK4 (0.44) | CDK4CCND1CDK6JAK2JAK3 | |
| SCHEMBL22650552 | 0.72 | CDK4 (0.53) | CDK4CCND1CDK6JAK2JAK3 | |
| SCHEMBL22650742 | 0.69 | TRPV1 (0.40) | CDK4CCND1CDK6HRH4 |
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 |