Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCND1 | P24385 | 13/20 | 0.39 |
| ▸ | CDK6 | Q00534 | 13/20 | 0.39 |
| ▸ | CDK2 | P24941 | 13/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 11/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.37 |
| ▸ | CCR6 | P51684 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 6/20 | 0.35 |
| ▸ | CCND3 | P30281 | 6/20 | 0.35 |
| ▸ | CDK1 | P06493 | 2/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.35 |
| ▸ | CDK7 | P50613 | 2/20 | 0.35 |
| ▸ | CCNH | P51946 | 2/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.35 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24676481 | 0.89 | CCND1 (0.40) | CCND1CDK6CDK2CCNE1TDO2 | |
| SCHEMBL24676010 | 0.88 | CCR6 (0.40) | CCND1CDK6CDK2CCNE1TDO2 | |
| SCHEMBL29754970 | 0.88 | CCR6 (0.40) | CCND1CDK6CDK2CCNE1TDO2 | |
| SCHEMBL24676488 | 0.80 | CDK2 (0.48) | CCND1CDK6CDK2CCNE1TDO2 | |
| SCHEMBL29754964 | 0.79 | CDK2 (0.49) | CCND1CDK6CDK2CCNE1TDO2 | |
| SCHEMBL24676002 | 0.79 | CDK2 (0.49) | CCND1CDK6CDK2CCNE1TDO2 | |
| SCHEMBL24676012 | 0.78 | GPR119 (0.45) | CCND1CDK6CDK2CCNE1TDO2 | |
| SCHEMBL24676773 | 0.78 | CDK2 (0.51) | CCND1CDK6CDK2CCNE1CDK4 | |
| SCHEMBL24676777 | 0.78 | CDK2 (0.51) | CCND1CDK6CDK2CCNE1CDK4 | |
| SCHEMBL24676671 | 0.78 | CDK2 (0.51) | CCND1CDK6CDK2CCNE1CDK4 |
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-2022155941-A1 | CDK2 INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2022-07-28 | — | — | WO | disclosed |