Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 19/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | ACACA | Q13085 | 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 | |
|---|---|---|---|---|
| SCHEMBL4458250 | 0.85 | CCR5 (0.64) | CCR5KCNH2CHRM2 | |
| SCHEMBL6008645 | 0.78 | CCR5 (0.78) | CCR5KCNH2CHRM2 | |
| SCHEMBL6008519 | 0.75 | CCR5 (0.88) | CCR5KCNH2 | |
| SCHEMBL6008097 | 0.75 | CCR5 (1.00) | CCR5 | |
| SCHEMBL4458526 | 0.75 | CCR5 (1.00) | CCR5 | |
| SCHEMBL6008552 | 0.75 | CCR5 (1.00) | CCR5 | |
| SCHEMBL6007479 | 0.75 | CCR5 (0.81) | CCR5KCNH2 | |
| SCHEMBL6006222 | 0.75 | CCR5 (0.87) | CCR5 | |
| SCHEMBL6008581 | 0.75 | CCR5 (0.73) | CCR5KCNH2 | |
| SCHEMBL6007326 | 0.74 | CCR5 (1.00) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1716156-A2 | CHEMOKINE CCR5 RECEPTOR MODULATORS | F.HOFFMANN-LA ROCHE AG (CH) | 2006-11-02 | — | — | EP | claimed |
| WO-2005075484-A2 | CHEMOKINE CCR5 RECEPTOR MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-08-18 | — | — | WO | claimed |