Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 13/20 | 0.67 |
| ▸ | CDK2 | P24941 | 6/20 | 0.45 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7829217 | 0.90 | GSK3B (0.58) | GSK3BCDK2CCNE1KDM4EALDH1A1 | |
| SCHEMBL7833824 | 0.90 | GSK3B (0.55) | GSK3BCDK2CCNE1KDM4EALDH1A1 | |
| SCHEMBL7831991 | 0.85 | GSK3B (0.50) | GSK3BCDK2KDM4EALDH1A1TSHR | |
| SCHEMBL7833111 | 0.83 | GSK3B (0.48) | GSK3BKDM4EALDH1A1HSD17B10ADORA3 | |
| SCHEMBL7832694 | 0.83 | GSK3B (0.50) | GSK3BCDK2KDM4EALDH1A1TSHR | |
| SCHEMBL7832341 | 0.82 | GSK3B (0.47) | GSK3BKDM4EALDH1A1ALOX15TSHR | |
| SCHEMBL12952870 | 0.80 | GSK3B (1.00) | GSK3BCDK2CCNE1 | |
| SCHEMBL7832777 | 0.76 | GSK3B (0.50) | GSK3BCDK2KDM4EALDH1A1TSHR | |
| SCHEMBL7832884 | 0.75 | GSK3B (0.50) | GSK3BCDK2KDM4EALDH1A1ALOX15 | |
| SCHEMBL12953212 | 0.74 | GSK3B (0.58) | GSK3BCDK2KDM4EALDH1A1ALOX15 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0820997-B1 | PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES | OTSUKA PHARMA CO LTD (JP) | 2001-07-25 | — | — | EP | disclosed |
| US-5985882-A | ANALGESICS | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1999-11-16 | — | — | US | disclosed |
| EP-0820997-A1 | PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1998-01-28 | — | — | EP | disclosed |