Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4685621 | 0.92 | CYP2D6 (0.47) | CYP2D6GAAMAPTALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL4682628 | 0.90 | CYP2D6 (0.48) | CYP2D6GAAMAPTALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL4682061 | 0.90 | CYP2D6 (0.45) | CYP2D6GAAMAPTALDH1A1MEN1 | |
| SCHEMBL4678497 | 0.88 | CYP2D6 (0.51) | CYP2D6GAAMAPTALDH1A1MEN1 | |
| SCHEMBL4679978 | 0.87 | ACKR3 (0.46) | CYP2D6MAPTALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL4682834 | 0.87 | CYP2D6 (0.48) | CYP2D6GAAMAPTALDH1A1MEN1 | |
| SCHEMBL4682819 | 0.84 | CYP2D6 (0.47) | CYP2D6GAAMAPTALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL4685531 | 0.84 | SMN1; SMN2 (0.48) | CYP2D6GAAMAPTALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL4685535 | 0.84 | SMN1; SMN2 (0.48) | CYP2D6GAAMAPTALDH1A1MEN1 | |
| SCHEMBL8132866 | 0.84 | CYP2D6 (0.51) | CYP2D6ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1058680-B1 | 2-ARYLETHYL-(PIPERIDIN-4-YLMETHYL)AMINE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2008-07-09 | — | — | EP | disclosed |
| US-6319920-B1 | MUSCARINIC RECEPTOR ANTAGONIST USED IN GASTROINTESTINAL, GENITOURINARY TRACT, RESPIRATORY TRACT, CARDIOVASCULAR SYSTEM, CENTRAL NERVOUS SYSTEM DISORDERS AND IN ANESTHESIOLOGY AND OPHTHALMOLOGY | SYNTEX (U.S.A.) LLC | 2001-11-20 | — | — | US | disclosed |