Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 20/20 | 0.62 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.62 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.62 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.62 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL7496702 | 1.00 | CCR5 (0.62) | CCR5CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL7663496 | 1.00 | CCR5 (0.62) | CCR5CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL7663490 | 1.00 | CCR5 (0.62) | CCR5CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL7972687 | 1.00 | CCR5 (0.62) | CCR5CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL7987257 | 0.86 | CCR5 (0.62) | CCR5 | |
| SCHEMBL7495708 | 0.86 | CCR5 (0.62) | CCR5 | |
| SCHEMBL7987259 | 0.86 | CCR5 (0.62) | CCR5 | |
| SCHEMBL7986278 | 0.85 | CCR5 (0.48) | CCR5CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL7986282 | 0.85 | CCR5 (0.48) | CCR5CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL7494907 | 0.83 | CCR5 (0.63) | 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 |