Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 7/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.62 |
| ▸ | WDR5 | P61964 | 11/20 | 0.42 |
| ▸ | GCGR | P47871 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16704325 | 0.93 | CYP2C9 (0.61) | CYP2C9CYP2C19CYP3A4ENPP2 | |
| SCHEMBL12295286 | 0.92 | CYP2C9 (0.63) | CYP2C9CYP2C19CYP3A4WDR5GCGR | |
| SCHEMBL12295470 | 0.90 | CYP2C9 (0.71) | CYP2C9CYP2C19CYP3A4ENPP2 | |
| SCHEMBL12294582 | 0.88 | CYP2C9 (0.58) | CYP2C9CYP2C19CYP3A4ENPP2 | |
| SCHEMBL12296316 | 0.88 | CYP2C9 (0.55) | CYP2C9CYP2C19CYP3A4ENPP2 | |
| SCHEMBL12294629 | 0.85 | CYP2C9 (0.63) | CYP2C9CYP2C19CYP3A4ENPP2 | |
| SCHEMBL12294627 | 0.85 | CYP2C9 (0.70) | CYP2C9CYP2C19CYP3A4ENPP2 | |
| SCHEMBL12295285 | 0.84 | CYP2C9 (0.62) | CYP2C9CYP2C19CYP3A4GCGR | |
| SCHEMBL12295420 | 0.84 | CYP2C9 (0.73) | CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL2402348 | 0.84 | CYP2C9 (0.68) | CYP2C9CYP2C19CYP3A4 |
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-2011113606-A1 | ANTI-INFECTIVE COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2011-09-22 | — | — | WO | disclosed |