Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 18/20 | 0.67 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8545581 | 0.80 | TACR1 (0.72) | TACR1SLC6A4 | |
| SCHEMBL5216125 | 0.80 | TACR1 (1.00) | TACR1SLC6A4 | |
| SCHEMBL8546545 | 0.79 | TACR1 (0.66) | TACR1SLC6A4 | |
| SCHEMBL8562729 | 0.79 | TACR1 (0.70) | TACR1SLC6A4 | |
| SCHEMBL17886658 | 0.79 | TACR1 (0.63) | TACR1ALOX15TSHR | |
| SCHEMBL8544652 | 0.78 | TACR1 (0.69) | TACR1SLC6A4 | |
| SCHEMBL8540809 | 0.77 | TACR1 (0.68) | TACR1SLC6A4 | |
| SCHEMBL8824359 | 0.77 | TACR1 (0.73) | TACR1SLC6A4 | |
| SCHEMBL8824352 | 0.77 | TACR1 (0.73) | TACR1SLC6A4 | |
| SCHEMBL13543974 | 0.76 | TACR1 (0.55) | TACR1ALOX15TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5760018-A | Gem-disubstituted azacyclic tachykinin antagonists | MERCK SHARP & DOHME LTD. (GB) | 1998-06-02 | — | — | US | disclosed |
| WO-1995019344-A1 | GEM-DISUBSTITUTED AZACYCLIC TACHYKININ ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1995-07-20 | — | — | WO | disclosed |