Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 11/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | KDM1A | O60341 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7492331 | 1.00 | CCR5 (0.48) | CCR5HRH3KDM1ARAB9AHTT | |
| SCHEMBL7544369 | 1.00 | CCR5 (0.48) | CCR5HRH3KDM1ARAB9AHTT | |
| SCHEMBL7931956 | 0.86 | CCR5 (0.52) | CCR5 | |
| SCHEMBL7499075 | 0.86 | CCR5 (0.52) | CCR5 | |
| SCHEMBL7943062 | 0.86 | CCR5 (0.52) | CCR5 | |
| SCHEMBL7986475 | 0.86 | HRH3 (0.44) | CCR5HRH3KDM1AHTT | |
| SCHEMBL7497446 | 0.86 | HRH3 (0.44) | CCR5HRH3KDM1AHTT | |
| SCHEMBL7986474 | 0.86 | HRH3 (0.44) | CCR5HRH3KDM1AHTT | |
| SCHEMBL7503238 | 0.80 | HRH3 (0.37) | CCR5HRH3KDM1AHTT | |
| SCHEMBL7938562 | 0.80 | HRH3 (0.37) | CCR5HRH3KDM1AHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-6265434-B1 | ANTIINFLAMMATORY AGENTS | MERCK & CO., INC. | 2001-07-24 | — | — | US | disclosed |
| US-6248755-B1 | ANTIINFLAMMATORY AGENTS; ANTIALLERGENS; AUTOIMMUNE DISEASES | MERCK & CO., INC. | 2001-06-19 | — | — | US | disclosed |