Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL2385435 | 0.84 | — | — | |
| SCHEMBL11277531 | 0.79 | CTSK (0.31) | — | |
| SCHEMBL1427315 | 0.78 | CYP3A4 (0.44) | CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL12424322 | 0.73 | SIGMAR1 (0.40) | — | |
| SCHEMBL2101479 | 0.73 | KDM4E (0.37) | — | |
| SCHEMBL4244448 | 0.72 | PIK3CD (0.32) | CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL4244451 | 0.72 | PIK3CD (0.32) | CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL12384443 | 0.72 | HRH3 (0.37) | — | |
| SCHEMBL13822254 | 0.72 | HRH3 (0.34) | — | |
| SCHEMBL11266835 | 0.71 | HTR2A (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2523957-A1 | TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF | F. Hoffmann-La Roche AG (CH) | 2012-11-21 | — | — | EP | disclosed |