Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 19/20 | 0.55 |
| ▸ | TACR3 | P29371 | 2/20 | 0.39 |
| ▸ | CETP | P11597 | 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 | |
|---|---|---|---|---|
| SCHEMBL8544652 | 0.81 | TACR1 (0.69) | TACR1TACR3 | |
| SCHEMBL8546545 | 0.79 | TACR1 (0.66) | TACR1TACR3 | |
| SCHEMBL8540809 | 0.76 | TACR1 (0.68) | TACR1TACR3 | |
| SCHEMBL5766180 | 0.75 | PPARA (0.44) | TACR1 | |
| SCHEMBL5766471 | 0.75 | PPARA (0.44) | TACR1 | |
| SCHEMBL7497146 | 0.73 | GPR119 (0.51) | — | |
| SCHEMBL7496058 | 0.73 | GPR119 (0.51) | — | |
| SCHEMBL25819373 | 0.73 | GPR119 (0.51) | — | |
| SCHEMBL3593353 | 0.72 | TACR1 (0.62) | TACR1TACR3 | |
| SCHEMBL3587155 | 0.72 | TACR1 (0.62) | TACR1TACR3 |
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-0739336-B1 | GEM-DISUBSTITUTED AZACYCLIC TACHYKININ ANTAGONISTS | MERCK SHARP & DOHME (GB) | 1998-08-26 | — | — | EP | disclosed |
| WO-1995019344-A1 | GEM-DISUBSTITUTED AZACYCLIC TACHYKININ ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1995-07-20 | — | — | WO | disclosed |