Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2837508 | 0.93 | CYP2C9 (0.50) | CYP2C9CYP3A4CYP2C19KCNH2 | |
| SCHEMBL6120324 | 0.88 | CYP3A4 (0.49) | CYP2C9CYP3A4CYP2C19KCNH2 | |
| SCHEMBL2838885 | 0.88 | CYP3A4 (0.51) | CYP2C9CYP3A4CYP2C19KCNH2 | |
| SCHEMBL2837509 | 0.87 | CYP3A4 (0.50) | CYP2C9CYP3A4CYP2C19KCNH2 | |
| SCHEMBL2839906 | 0.86 | CYP3A4 (0.52) | CYP2C9CYP3A4CYP2C19KCNH2 | |
| SCHEMBL6119339 | 0.86 | CYP3A4 (0.49) | CYP2C9CYP3A4CYP2C19KCNH2 | |
| SCHEMBL2843854 | 0.84 | CYP3A4 (0.51) | CYP2C9CYP3A4CYP2C19KCNH2 | |
| SCHEMBL2835951 | 0.84 | CYP3A4 (0.51) | CYP2C9CYP3A4CYP2C19KCNH2 | |
| SCHEMBL2841638 | 0.84 | CYP3A4 (0.51) | CYP2C9CYP3A4CYP2C19KCNH2 | |
| SCHEMBL3397081 | 0.84 | CYP3A4 (0.48) | CYP2C9CYP3A4CYP2C19KCNH2 |
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-2012067663-A1 | COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-05-24 | — | — | WO | disclosed |