Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4791003 | 0.93 | CYP2C9 (0.44) | CYP2C9CYP3A4CYP2C19KCNH2CACNA1C | |
| SCHEMBL6119378 | 0.90 | ANO1 (0.43) | CYP2C9CYP3A4CYP2C19KCNH2 | |
| SCHEMBL2845769 | 0.88 | CYP2C9 (0.48) | CYP2C9CYP3A4CYP2C19KCNH2CACNA1C | |
| SCHEMBL15385038 | 0.87 | CYP2C9 (0.40) | CYP2C9CYP3A4CYP2C19KCNH2CACNA1C | |
| SCHEMBL6120166 | 0.87 | CYP3A4 (0.46) | CYP2C9CYP3A4CYP2C19KCNH2CYP2C8 | |
| SCHEMBL2838530 | 0.87 | CYP2C9 (0.46) | CYP2C9CYP3A4CYP2C19KCNH2CACNA1C | |
| SCHEMBL2403086 | 0.86 | CYP2C9 (0.46) | CYP2C9CYP3A4CYP2C19KCNH2CACNA1C | |
| SCHEMBL29950180 | 0.85 | CYP2C9 (0.43) | CYP2C9CYP3A4CYP2C19KCNH2CACNA1C | |
| SCHEMBL2363613 | 0.85 | CYP2C9 (0.43) | CYP2C9CYP3A4CYP2C19KCNH2CACNA1C | |
| SCHEMBL2843678 | 0.85 | CYP2C9 (0.50) | CYP2C9CYP3A4CYP2C19KCNH2CACNA1C |
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 |