Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 16/20 | 0.47 |
| ▸ | CCR2 | P41597 | 3/20 | 0.38 |
| ▸ | STS | P08842 | 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 | |
|---|---|---|---|---|
| SCHEMBL8328424 | 0.86 | TACR1 (0.52) | TACR1 | |
| SCHEMBL8322669 | 0.86 | TACR1 (0.52) | TACR1 | |
| SCHEMBL5213936 | 0.85 | TACR1 (0.56) | TACR1 | |
| SCHEMBL5213929 | 0.85 | TACR1 (0.56) | TACR1 | |
| SCHEMBL5213943 | 0.85 | TACR1 (0.56) | TACR1 | |
| SCHEMBL7205307 | 0.81 | TACR1 (0.52) | TACR1 | |
| SCHEMBL7190390 | 0.79 | TACR1 (0.54) | TACR1 | |
| SCHEMBL7180363 | 0.75 | TACR1 (0.65) | TACR1 | |
| SCHEMBL7180360 | 0.75 | TACR1 (0.65) | TACR1 | |
| SCHEMBL8700110 | 0.75 | TACR1 (0.61) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1322596-A1 | ZWITTERIONIC TACHYKININ RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 2003-07-02 | — | — | EP | disclosed |
| WO-2002024629-A1 | ZWITTERIONIC TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2002-03-28 | — | — | WO | disclosed |