Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 14/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | SI | P14410 | 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 | |
|---|---|---|---|---|
| SCHEMBL8630684 | 1.00 | TACR1 (0.48) | TACR1CYP2D6MGAMSI | |
| SCHEMBL14414161 | 0.72 | TACR1 (0.52) | TACR1CYP2D6 | |
| SCHEMBL8400412 | 0.69 | HTR1D (0.43) | — | |
| SCHEMBL6153101 | 0.69 | TACR1 (0.49) | TACR1CYP2D6 | |
| SCHEMBL7835544 | 0.68 | TACR1 (0.47) | TACR1CYP2D6 | |
| SCHEMBL7835551 | 0.68 | TACR1 (0.47) | TACR1CYP2D6 | |
| SCHEMBL8917204 | 0.68 | TACR1 (0.76) | TACR1CYP2D6 | |
| SCHEMBL8917194 | 0.68 | TACR1 (0.76) | TACR1CYP2D6 | |
| SCHEMBL8917197 | 0.68 | TACR1 (0.76) | TACR1CYP2D6 | |
| Hydrochloric Acid SCHEMBL8917606 | 0.68 | TACR1 (0.48) | TACR1CYP2D6 |
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-5728716-A | Aralkylamino substituted azacyclic therapeutic agents | MERCK SHARP & DOHME LIMITED (GB) | 1998-03-17 | — | — | US | disclosed |