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 | |
|---|---|---|---|---|
| SCHEMBL3592502 | 0.88 | TACR1 (0.77) | TACR1SLC6A4 | |
| SCHEMBL3591663 | 0.87 | TACR1 (0.74) | TACR1SLC6A4 | |
| SCHEMBL13404090 | 0.87 | TACR1 (0.79) | TACR1SLC6A4 | |
| SCHEMBL14723673 | 0.86 | TACR1 (0.70) | TACR1SLC6A4 | |
| SCHEMBL14723674 | 0.86 | TACR1 (0.72) | TACR1SLC6A4 | |
| SCHEMBL13404109 | 0.86 | TACR1 (0.78) | TACR1SLC6A4 | |
| SCHEMBL13404096 | 0.85 | TACR1 (0.91) | TACR1SLC6A4 | |
| SCHEMBL3605454 | 0.84 | TACR1 (0.68) | TACR1SLC6A4 | |
| SCHEMBL13404164 | 0.84 | TACR1 (0.85) | TACR1SLC6A4 | |
| SCHEMBL13404184 | 0.84 | TACR1 (0.71) | TACR1SLC6A4 |
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-8383821-B2 | NK-1 and serotonin transporter inhibitors | BRISTOL-MEYERS SQUIBB COMPANY (US) | 2013-02-26 | — | — | US | disclosed |