Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 14/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 14/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 14/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 14/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31663317 | 0.91 | CYP2D6 (0.32) | CYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28383552 | 0.87 | CYP2D6 (0.34) | CYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2473117 | 0.83 | OPRM1 (0.36) | CYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4139636 | 0.82 | PPM1D (0.32) | — | |
| SCHEMBL29896716 | 0.79 | SLC6A2 (0.37) | CYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL15776868 | 0.78 | CYP2C19 (0.43) | — | |
| SCHEMBL25568329 | 0.74 | PPM1D (0.34) | — | |
| SCHEMBL29546215 | 0.73 | — | — | |
| Trifluoroacetic Acid SCHEMBL23390509 | 0.70 | POLB (0.31) | — | |
| SCHEMBL3880022 | 0.70 | P2RX7 (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1984331-A1 | PYRROLIDINE DERIVATIVES AS ERK INHIBITORS | SCHERING CORPORATION (US) | 2008-10-29 | — | — | EP | disclosed |
| WO-2007097937-A1 | PYRROLIDINE DERIVATIVES AS ERK INHIBITORS | SCHERING CORPORATION (US) | 2007-08-30 | — | — | WO | disclosed |