Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 17/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.56 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1388687 | 0.99 | TACR1 (0.58) | TACR1SLC6A4KCNH2 | |
| SCHEMBL3595110 | 0.82 | TACR1 (0.48) | TACR1SLC6A4KCNH2 | |
| SCHEMBL3596809 | 0.82 | TACR1 (0.54) | TACR1SLC6A4KCNH2 | |
| SCHEMBL3589377 | 0.81 | TACR1 (0.59) | TACR1 | |
| SCHEMBL8124474 | 0.79 | TACR1 (0.59) | TACR1SLC6A4KCNH2 | |
| Hydrochloric Acid SCHEMBL1388317 | 0.78 | TACR1 (0.58) | TACR1SLC6A4KCNH2 | |
| SCHEMBL3590159 | 0.78 | TACR1 (0.60) | TACR1SLC6A4KCNH2 | |
| SCHEMBL3596983 | 0.77 | TACR1 (0.49) | TACR1SLC6A4KCNH2 | |
| SCHEMBL5446697 | 0.77 | TACR1 (0.49) | TACR1SLC6A4KCNH2 | |
| SCHEMBL14403909 | 0.77 | TACR1 (0.49) | TACR1SLC6A4KCNH2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0666856-B1 | 4-ARYLMETHYLOXYMETHYL PIPERIDINES AS TACHYKININ ANTAGONISTS | MERCK SHARP & DOHME (GB) | 2000-01-05 | — | — | EP | claimed |