Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 15/20 | 0.76 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL7829388 | 0.87 | CCR5 (0.79) | CCR5 | |
| SCHEMBL7839328 | 0.87 | CCR5 (1.00) | CCR5 | |
| SCHEMBL8090855 | 0.85 | CCR5 (0.75) | CCR5 | |
| SCHEMBL7833271 | 0.82 | CCR5 (0.89) | CCR5 | |
| SCHEMBL7829652 | 0.81 | CCR5 (0.69) | CCR5MEN1KMT2A | |
| SCHEMBL7838237 | 0.80 | CCR5 (1.00) | CCR5 | |
| SCHEMBL7874883 | 0.78 | CCR5 (0.82) | CCR5 | |
| SCHEMBL7870830 | 0.78 | CCR5 (0.82) | CCR5 | |
| SCHEMBL7870825 | 0.78 | CCR5 (0.82) | CCR5 | |
| SCHEMBL7874833 | 0.78 | CCR5 (0.82) | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1009405-A4 | PYRROLIDINE AND PIPERIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO INC (US) | 2001-05-09 | — | — | EP | disclosed |
| US-6166037-A | Pyrrolidine and piperidine modulators of chemokine receptor activity | MERCK & CO., INC. (US) | 2000-12-26 | — | — | US | disclosed |
| EP-1009405-A1 | PYRROLIDINE AND PIPERIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | Merck & Co., Inc. (US) | 2000-06-21 | — | — | EP | disclosed |
| WO-1999009984-A1 | PYRROLIDINE AND PIPERIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 1999-03-04 | — | — | WO | disclosed |