Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | CASR | P41180 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21115329 | 0.92 | GRIN1 (0.53) | PGRALDH1A1KDM4EGRIN1GRIN2B | |
| SCHEMBL21115333 | 0.90 | PDE4B (0.49) | PGRALDH1A1KDM4EGRIN1GRIN2B | |
| SCHEMBL21112835 | 0.90 | GRIN1 (0.47) | PGRALDH1A1KDM4EGRIN1GRIN2B | |
| SCHEMBL21113907 | 0.89 | GRIN1 (0.49) | PGRALDH1A1KDM4EGRIN1GRIN2B | |
| SCHEMBL22753885 | 0.88 | PDE4B (0.51) | PGRALDH1A1KDM4EGRIN1GRIN2B | |
| SCHEMBL21113756 | 0.86 | PDE4B (0.51) | PGRALDH1A1KDM4EGRIN1GRIN2B | |
| SCHEMBL21117547 | 0.85 | PDE4B (0.52) | ALDH1A1KDM4EGRIN1GRIN2BHSD17B10 | |
| SCHEMBL22753865 | 0.84 | PDE4B (0.50) | PGRALDH1A1KDM4EGRIN1GRIN2B | |
| SCHEMBL21113745 | 0.83 | USP2 (0.56) | ALDH1A1KDM4EGRIN1GRIN2BHSD17B10 | |
| SCHEMBL21113905 | 0.83 | GRIN1 (0.49) | PGRALDH1A1KDM4EGRIN1GRIN2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3502099-B1 | CYCLIC COMPOUND ACTING AS PDE4 INHIBITOR | MEDSHINE DISCOVERY INC (CN) | 2020-12-09 | — | — | EP | disclosed |
| EP-3502099-A1 | CYCLIC COMPOUND ACTING AS PDE4 INHIBITOR | Medshine Discovery Inc. (CN) | 2019-06-26 | — | — | EP | disclosed |