Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 19/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4491848 | 0.87 | CNR1 (0.57) | CNR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4479631 | 0.78 | CNR1 (0.64) | CNR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4481857 | 0.77 | CNR1 (0.64) | CNR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4491826 | 0.76 | CNR1 (0.53) | CNR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4488160 | 0.75 | CNR1 (0.54) | CNR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4476928 | 0.75 | CNR1 (0.52) | CNR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4486448 | 0.75 | CNR1 (0.53) | CNR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4478487 | 0.75 | CNR1 (0.52) | CNR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4478611 | 0.75 | CNR1 (0.51) | CNR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4484312 | 0.75 | CNR1 (0.55) | CNR1CYP2C9CYP2C19CYP3A4 |
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-1891068-A1 | TRIAZOLOPYRIDINE DERIVATIVES AS CANNABINOID RECEPTOR 1 ANTAGONISTS | Bristol-Myers Squibb Company (US) | 2008-02-27 | — | — | EP | disclosed |
| WO-2006138695-A1 | TRIAZOLOPYRIDINE DERIVATIVES AS CANNABINOID RECEPTOR 1 ANTAGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-12-28 | — | — | WO | disclosed |