Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 13/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.45 |
| ▸ | STS | P08842 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13345854 | 1.00 | EPHX2 (0.56) | EPHX2CYP2D6MEN1KMT2ACYP2C8 | |
| SCHEMBL3466847 | 0.88 | CCR5 (0.51) | EPHX2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL13345602 | 0.88 | CCR5 (0.51) | EPHX2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL16565439 | 0.87 | MEN1 (0.51) | EPHX2CYP2D6MEN1KMT2ASTS | |
| SCHEMBL13345075 | 0.85 | MEN1 (0.50) | EPHX2CYP2D6MEN1KMT2ACYP2C8 | |
| SCHEMBL1981949 | 0.85 | MEN1 (0.50) | EPHX2CYP2D6MEN1KMT2ACYP2C8 | |
| SCHEMBL13345857 | 0.84 | EPHX2 (0.47) | EPHX2CYP2D6MEN1KMT2ACYP2C8 | |
| SCHEMBL7000547 | 0.82 | TACR1 (0.54) | EPHX2CYP2D6 | |
| SCHEMBL7955246 | 0.82 | CCR5 (0.49) | EPHX2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL6544379 | 0.82 | CCR5 (0.49) | EPHX2CYP2D6CYP2C9CYP3A4 |
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-2010071575-A1 | QUATERNARY PIPERIDINE DERIVATIVES AND USES THEREOF | ASTRAZENECA AB (SE) | 2010-06-24 | — | — | WO | disclosed |