Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.31 |
| ▸ | OGA | O60502 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4501906 | 0.79 | CYP2D6 (0.44) | CCR5 | |
| SCHEMBL15105081 | 0.79 | CYP2D6 (0.44) | CCR5 | |
| SCHEMBL15105078 | 0.79 | CYP2D6 (0.44) | CCR5 | |
| SCHEMBL4499497 | 0.79 | CYP2D6 (0.44) | CCR5 | |
| SCHEMBL16244888 | 0.79 | CYP2D6 (0.44) | CCR5 | |
| SCHEMBL428075 | 0.79 | CYP2D6 (0.44) | CCR5 | |
| SCHEMBL4499500 | 0.79 | CYP2D6 (0.44) | CCR5 | |
| SCHEMBL4503592 | 0.79 | CYP2D6 (0.44) | CCR5 | |
| SCHEMBL21058681 | 0.79 | CYP2D6 (0.44) | CCR5 | |
| SCHEMBL8661303 | 0.74 | OGA (0.38) | CHRM2OGA |
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 |
|---|---|---|---|---|---|---|---|
| US-5756508-A | Muscarine antagonists | MERCK & CO., INC. (US) | 1998-05-26 | — | — | US | disclosed |