Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 13/20 | 0.53 |
| ▸ | GBA1 | P04062 | 2/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7490631 | 1.00 | CCR5 (0.53) | CCR5GBA1RORCGRIN2BHTT | |
| SCHEMBL5235973 | 0.79 | GBA1 (0.63) | CCR5GBA1RORC | |
| SCHEMBL417494 | 0.79 | GBA1 (0.63) | CCR5GBA1RORC | |
| SCHEMBL7817708 | 0.79 | GBA1 (0.63) | CCR5GBA1RORC | |
| SCHEMBL4099146 | 0.78 | CCR5 (0.48) | CCR5 | |
| SCHEMBL7972599 | 0.77 | CCR5 (0.44) | CCR5RORCGRIN2BHTT | |
| SCHEMBL7499305 | 0.77 | CCR5 (0.44) | CCR5RORCGRIN2BHTT | |
| SCHEMBL7982834 | 0.76 | CCR5 (0.44) | CCR5 | |
| SCHEMBL7501730 | 0.76 | CCR5 (0.44) | CCR5 | |
| SCHEMBL4108008 | 0.75 | CCR5 (0.46) | CCR5RORC |
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 |