Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 15/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7491806 | 1.00 | CCR5 (0.54) | CCR5HRH3HTTKCNH2 | |
| SCHEMBL7972491 | 1.00 | CCR5 (0.54) | CCR5HRH3HTTKCNH2 | |
| SCHEMBL7495965 | 0.86 | CCR5 (0.59) | CCR5 | |
| SCHEMBL7986615 | 0.86 | CCR5 (0.59) | CCR5 | |
| SCHEMBL7986611 | 0.86 | CCR5 (0.59) | CCR5 | |
| SCHEMBL7497787 | 0.81 | CCR5 (0.54) | CCR5 | |
| SCHEMBL7939772 | 0.81 | CCR5 (0.54) | CCR5 | |
| SCHEMBL7940905 | 0.81 | CCR5 (0.54) | CCR5 | |
| SCHEMBL7941000 | 0.81 | CCR5 (0.54) | CCR5 | |
| SCHEMBL7941215 | 0.81 | CCR5 (0.54) | CCR5 |
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-6265434-B1 | ANTIINFLAMMATORY AGENTS | MERCK & CO., INC. | 2001-07-24 | — | — | US | disclosed |