Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 7/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 8/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.34 |
| ▸ | TOP2A | P11388 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7982834 | 1.00 | CCR5 (0.44) | CCR5RIPK1NTRK1TOP2A | |
| SCHEMBL7494075 | 0.88 | CCR5 (0.40) | CCR5RIPK1NTRK1 | |
| SCHEMBL7939841 | 0.88 | CCR5 (0.40) | CCR5RIPK1NTRK1 | |
| SCHEMBL4111698 | 0.83 | CCR5 (0.39) | CCR5 | |
| SCHEMBL6104527 | 0.83 | CCR5 (0.50) | CCR5 | |
| SCHEMBL4093859 | 0.83 | CCR5 (0.39) | CCR5 | |
| SCHEMBL6104528 | 0.83 | CCR5 (0.50) | CCR5 | |
| SCHEMBL7987323 | 0.81 | CCR5 (0.46) | CCR5 | |
| SCHEMBL7987329 | 0.81 | CCR5 (0.46) | CCR5 | |
| SCHEMBL4108752 | 0.80 | RORC (0.40) | CCR5RIPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1173170-A4 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO INC (US) | 2002-05-29 | — | — | EP | disclosed |
| EP-1173170-A1 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | Merck & Co., Inc. (US) | 2002-01-23 | — | — | EP | disclosed |
| US-6265434-B1 | ANTIINFLAMMATORY AGENTS | MERCK & CO., INC. | 2001-07-24 | — | — | US | disclosed |
| WO-2000059503-A1 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 2000-10-12 | — | — | WO | disclosed |