Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 18/20 | 0.40 |
| ▸ | CCR5 | P51681 | 2/20 | 0.39 |
| ▸ | TACR2 | P21452 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7956549 | 0.90 | TACR1 (0.49) | TACR1CCR5 | |
| SCHEMBL4630722 | 0.89 | TACR1 (0.38) | TACR1TACR2 | |
| SCHEMBL8484370 | 0.87 | TACR1 (0.50) | TACR1TACR2 | |
| SCHEMBL8478723 | 0.82 | TACR1 (0.41) | TACR1TACR2 | |
| SCHEMBL4630597 | 0.82 | P2RX3 (0.36) | TACR1TACR2 | |
| SCHEMBL8351679 | 0.82 | TACR1 (0.40) | TACR1CCR5TACR2 | |
| SCHEMBL8300796 | 0.82 | TACR1 (0.59) | TACR1CCR5TACR2 | |
| SCHEMBL8353594 | 0.80 | KDM4C (0.41) | TACR1CCR5 | |
| SCHEMBL7765748 | 0.79 | CCR5 (0.41) | TACR1CCR5TACR2 | |
| SCHEMBL7817874 | 0.79 | TACR1 (0.54) | TACR1 |
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-1101757-A1 | Heterocyclic compounds as tachykinin receptor antagonists | SANOFI-SYNTHELABO (FR) | 2001-05-23 | — | — | EP | disclosed |
| US-5859029-A | TREATING SUBSTANCE P-DEPENDENT PATHOLOGICAL CONDITIONS | SANOFI (FR) | 1999-01-12 | — | — | US | disclosed |
| US-5656639-A | POSSESS STRONG AFFINITY FOR NK1 RECEPTORS; USEFUL IN TREATMENT OF SUBSTANCE P-DEPENDENT PATHOLOGICAL CONDITIONS | SANOFI (FR) | 1997-08-12 | — | — | US | disclosed |
| EP-0723959-A1 | Heterocyclic compounds as tachykinin receptor antagonists, process for their preparation and pharmaceuticals containing them | SANOFI (FR) | 1996-07-31 | — | — | EP | disclosed |