Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 20/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 20/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 16/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28958068 | 1.00 | SLC6A2 (0.39) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL20230990 | 1.00 | SLC6A2 (0.39) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL31514863 | 0.86 | CPN1 (0.41) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL31514862 | 0.86 | CPN1 (0.41) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL1689631 | 0.85 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL20234883 | 0.84 | SLC6A2 (0.35) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3159514 | 0.82 | SLC6A2 (0.37) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL24779908 | 0.79 | — | — | |
| SCHEMBL13088787 | 0.79 | — | — | |
| SCHEMBL25133345 | 0.74 | — | — |
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-2014140310-A1 | PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY | AbbVie Deutschland GmbH & Co. KG (DE) | 2014-09-18 | — | — | WO | disclosed |