Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL6479078 | 0.82 | TACR1 (1.00) | TACR1 | |
| SCHEMBL6481330 | 0.80 | TACR1 (1.00) | TACR1 | |
| SCHEMBL6479772 | 0.77 | TACR1 (0.61) | TACR1 | |
| SCHEMBL6490045 | 0.76 | TACR1 (0.61) | TACR1 | |
| SCHEMBL17012712 | 0.71 | TACR1 (0.66) | TACR1TACR3 | |
| SCHEMBL17012677 | 0.71 | TACR1 (0.66) | TACR1TACR3 | |
| SCHEMBL4800291 | 0.68 | OPRM1 (0.56) | — | |
| SCHEMBL6478071 | 0.67 | TACR1 (1.00) | TACR1 | |
| SCHEMBL9317434 | 0.67 | TACR1 (0.70) | TACR1TACR3 | |
| SCHEMBL6480884 | 0.66 | TACR1 (1.00) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6916797-B2 | α-arylethylpiperazine derivatives as neurokinin antagonists | UCB, S.A. (BE) | 2005-07-12 | — | — | US | claimed |