Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | HEXA | P06865 | 1/20 | 0.33 |
| ▸ | HEXB | P07686 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | TKT | P29401 | 1/20 | 0.31 |
| ▸ | MBOAT4 | Q96T53 | 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 | |
|---|---|---|---|---|
| SCHEMBL4488040 | 0.82 | CNR1 (0.36) | CNR1HEXAHEXBTRPV1KDM4E | |
| SCHEMBL4492952 | 0.82 | TKT (0.36) | CNR1HEXAHEXBTRPV1KDM4E | |
| SCHEMBL4484041 | 0.78 | KDM4E (0.39) | CNR1TRPV1KDM4ECXCR4TKT | |
| SCHEMBL25271011 | 0.78 | HEXA (0.34) | HEXAHEXBKDM4ECXCR4PDE4B | |
| SCHEMBL30408730 | 0.78 | HEXA (0.34) | HEXAHEXBKDM4ECXCR4PDE4B | |
| SCHEMBL13697560 | 0.76 | TRPV1 (0.38) | TRPV1KDM4ECXCR4TKT | |
| SCHEMBL21419162 | 0.76 | HEXA (0.35) | HEXAHEXBKDM4ECXCR4PDE4B | |
| SCHEMBL22868494 | 0.75 | CYP3A4 (0.34) | HEXAHEXBTRPV1KDM4ECXCR4 | |
| SCHEMBL5036133 | 0.74 | TRPV1 (0.37) | TRPV1KDM4E | |
| SCHEMBL16068142 | 0.74 | HEXA (0.41) | HEXAHEXBKDM4ECXCR4PDE4B |
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 |