Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 10/20 | 0.37 |
| ▸ | CCND1 | P24385 | 10/20 | 0.37 |
| ▸ | CCND3 | P30281 | 9/20 | 0.37 |
| ▸ | CDK6 | Q00534 | 9/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 6/20 | 0.34 |
| ▸ | CDK2 | P24941 | 6/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 6/20 | 0.34 |
| ▸ | CDK5R1 | Q15078 | 6/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 5/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650372 | 0.90 | SMN1; SMN2 (0.36) | CDK4CCND1CCND3CDK6SMN1; SMN2 | |
| SCHEMBL22650360 | 0.89 | SMN1; SMN2 (0.41) | CDK4CCND1CCND3CDK6SMN1; SMN2 | |
| SCHEMBL30888943 | 0.81 | CDK4 (0.50) | CDK4CCND1CCND3CDK6CCNA2 | |
| SCHEMBL29491131 | 0.79 | MAPK14 (0.40) | SMN1; SMN2CCNA2CDK2CDK5CDK5R1 | |
| SCHEMBL22650600 | 0.79 | MAPK14 (0.40) | SMN1; SMN2CCNA2CDK2CDK5CDK5R1 | |
| SCHEMBL22650721 | 0.77 | SMN1; SMN2 (0.34) | CDK4CCND1CCND3CDK6SMN1; SMN2 | |
| SCHEMBL29491171 | 0.76 | SMN1; SMN2 (0.45) | SMN1; SMN2CCNA2CDK2CDK5CDK5R1 | |
| SCHEMBL22650746 | 0.76 | SMN1; SMN2 (0.45) | SMN1; SMN2CCNA2CDK2CDK5CDK5R1 | |
| SCHEMBL24632941 | 0.74 | CDK4 (0.43) | CDK4CCND1CCND3CDK6SMN1; SMN2 | |
| SCHEMBL30889011 | 0.71 | CDK4 (0.42) | CDK4CCND1CCND3CDK6CCNA2 |
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 |