Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 3/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24992026 | 1.00 | PIK3CD (0.50) | PIK3CDHRH3CYP2D6SMN1; SMN2 | |
| SCHEMBL17285927 | 1.00 | PIK3CD (0.50) | PIK3CDHRH3CYP2D6SMN1; SMN2 | |
| SCHEMBL18926695 | 0.89 | PIK3CD (0.58) | PIK3CDHRH3CYP2D6SMN1; SMN2 | |
| SCHEMBL25160490 | 0.82 | PIK3CD (0.35) | PIK3CD | |
| SCHEMBL24841928 | 0.82 | PIK3CD (0.58) | PIK3CDHRH3CYP2D6SMN1; SMN2 | |
| SCHEMBL27284835 | 0.82 | PIK3CD (0.58) | PIK3CDHRH3CYP2D6SMN1; SMN2 | |
| SCHEMBL24842077 | 0.82 | PIK3CD (0.52) | PIK3CDHRH3CYP2D6SMN1; SMN2 | |
| SCHEMBL17624551 | 0.81 | PIK3CD (0.33) | PIK3CD | |
| SCHEMBL23374642 | 0.81 | PIK3CD (0.34) | PIK3CD | |
| SCHEMBL22305201 | 0.79 | PIK3CD (0.41) | PIK3CDHRH3CYP2D6SMN1; SMN2 |
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-2021154665-A1 | 1H-PYRAZOLO[4,3-d]PYRIMIDINE COMPOUNDS AS TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2021-08-05 | — | — | WO | disclosed |