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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5764991 | 0.99 | CCR5 (0.77) | CCR5KCNH2 | |
| SCHEMBL7546738 | 0.95 | CCR5 (0.86) | CCR5KCNH2 | |
| Hydrochloric Acid SCHEMBL5764025 | 0.94 | CCR5 (0.85) | CCR5KCNH2 | |
| SCHEMBL7546381 | 0.89 | CCR5 (0.88) | CCR5KCNH2 | |
| SCHEMBL7546882 | 0.89 | CCR5 (0.85) | CCR5KCNH2 | |
| SCHEMBL7549046 | 0.89 | CCR5 (0.87) | CCR5KCNH2 | |
| Hydrochloric Acid SCHEMBL5764811 | 0.89 | CCR5 (0.87) | CCR5KCNH2 | |
| Hydrochloric Acid SCHEMBL5765139 | 0.89 | CCR5 (0.82) | CCR5KCNH2 | |
| Hydrochloric Acid SCHEMBL5765017 | 0.89 | CCR5 (0.84) | CCR5KCNH2 | |
| Hydrochloric Acid SCHEMBL5765761 | 0.89 | CCR5 (0.86) | 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-1192133-A1 | N-CYCLOPENTYL MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | Merck & Co., Inc. (US) | 2002-04-03 | — | — | EP | disclosed |
| WO-2000076972-A1 | N-CYCLOPENTYL MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 2000-12-21 | — | — | WO | disclosed |