Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | PDE8A | O60658 | 3/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 7/20 | 0.33 |
| ▸ | CDK2 | P24941 | 7/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 7/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 6/20 | 0.33 |
| ▸ | CDK5R1 | Q15078 | 6/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.31 |
| ▸ | APAF1 | O14727 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650407 | 0.87 | L3MBTL1 (0.37) | MAPK14SMN1; SMN2PDE8APDE2APDE4D | |
| SCHEMBL29491131 | 0.82 | MAPK14 (0.40) | MAPK14SMN1; SMN2PDE8APDE2APDE4D | |
| SCHEMBL22650600 | 0.82 | MAPK14 (0.40) | MAPK14SMN1; SMN2PDE8APDE2APDE4D | |
| SCHEMBL29491141 | 0.80 | SMN1; SMN2 (0.37) | MAPK14SMN1; SMN2CCNA2CDK2CCNA1 | |
| SCHEMBL22650503 | 0.74 | MAPK14 (0.46) | MAPK14SMN1; SMN2CCNA2CDK2CCNA1 | |
| SCHEMBL22650721 | 0.69 | SMN1; SMN2 (0.34) | SMN1; SMN2CCNA2CDK2CCNA1CDK5 | |
| SCHEMBL22650827 | 0.68 | CDK4 (0.39) | CDK2CDK1 | |
| SCHEMBL30038555 | 0.68 | MAPK14 (0.42) | MAPK14SMN1; SMN2CDK2DYRK1ACDK1 | |
| SCHEMBL19836336 | 0.68 | MAPK14 (0.42) | MAPK14SMN1; SMN2CDK2DYRK1ACDK1 | |
| SCHEMBL22650362 | 0.65 | CDK4 (0.36) | CDK2CDK1 |
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 |