Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 11/20 | 0.73 |
| ▸ | CYP2C9 | P11712 | 10/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.73 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.73 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.73 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.73 |
| ▸ | CA1 | P00915 | 2/20 | 0.63 |
| ▸ | CA2 | P00918 | 2/20 | 0.63 |
| ▸ | CA9 | Q16790 | 2/20 | 0.63 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.49 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8794660 | 0.98 | CYP2D6 (0.71) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL8794629 | 0.98 | CYP2D6 (0.71) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL8588788 | 0.98 | CYP2D6 (0.71) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL8794039 | 0.98 | CYP2D6 (0.71) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL8484014 | 0.98 | CYP2D6 (0.71) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL8795724 | 0.95 | CYP2D6 (0.75) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL8483819 | 0.94 | CYP2D6 (0.73) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL5202195 | 0.91 | CYP2D6 (0.72) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL8781232 | 0.89 | CYP2D6 (0.70) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL14129854 | 0.84 | CYP2D6 (1.00) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 |
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-0792873-A1 | N-(Phenoxyalkyl) carboxamides and their use as antiarrhythmic agents | American Cyanamid Company (US) | 1997-09-03 | — | — | EP | disclosed |