Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL6449498 | 0.90 | CCR5 (0.92) | CCR5KCNH2 | |
| SCHEMBL4465719 | 0.86 | CCR5 (1.00) | CCR5KCNH2 | |
| SCHEMBL6007035 | 0.84 | CCR5 (0.84) | CCR5KCNH2 | |
| Trifluoroacetic Acid SCHEMBL6005915 | 0.84 | CCR5 (0.74) | CCR5KCNH2 | |
| SCHEMBL6005874 | 0.82 | CCR5 (0.80) | CCR5KCNH2 | |
| Trifluoroacetic Acid SCHEMBL6008355 | 0.82 | CCR5 (0.71) | CCR5 | |
| SCHEMBL4458249 | 0.82 | CCR5 (1.00) | CCR5 | |
| SCHEMBL4465187 | 0.82 | CCR5 (1.00) | CCR5 | |
| SCHEMBL4458255 | 0.82 | CCR5 (1.00) | CCR5 | |
| Trifluoroacetic Acid SCHEMBL6008459 | 0.82 | CCR5 (0.71) | CCR5KCNH2 |
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 |