Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9503545 | 0.82 | CYP2D6 (0.58) | HTR2AHTR2CKCNH2ALDH1A1CYP2D6 | |
| SCHEMBL9501134 | 0.74 | CYP2D6 (0.73) | HTR2AHTR2CKCNH2ALDH1A1CYP2D6 | |
| SCHEMBL9079349 | 0.70 | CYP2D6 (0.58) | HTR2AHTR2CKCNH2ALDH1A1CYP2D6 | |
| SCHEMBL10461157 | 0.70 | ACHE (0.51) | HTR2AHTR2CKCNH2ALDH1A1CYP2D6 | |
| SCHEMBL2537406 | 0.70 | KMT2A (0.59) | ALDH1A1GAAPKMKMT2AMEN1 | |
| SCHEMBL17180248 | 0.69 | MEN1 (0.71) | HTR2AHTR2CKCNH2ALDH1A1CYP2D6 | |
| SCHEMBL11791324 | 0.69 | HTR2A (0.61) | HTR2AHTR2CKCNH2ALDH1A1CYP2D6 | |
| Hydrochloric Acid SCHEMBL9369828 | 0.69 | ACHE (0.50) | HTR2AHTR2CKCNH2ALDH1A1CYP2D6 | |
| SCHEMBL7635691 | 0.68 | ACHE (0.42) | ALDH1A1GAATSHRKMT2AMEN1 | |
| SCHEMBL6585664 | 0.67 | HTR2A (0.78) | HTR2AHTR2CKCNH2ALDH1A1CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0325268-B1 | 1,4-DISUBSTITUTED-PIPERIDINYL COMPOUNDS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1993-06-02 | — | — | EP | disclosed |
| US-5162342-A | USE OF 1,4-DISUBSTITUTED-PIPERIDINYL COMPOUNDS FOR ANALGESIA AND MUSCLE RELAXATION | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-11-10 | — | — | US | disclosed |
| US-5064838-A | 1,4-DISUBSTITUTED-PIPERIDINYL COMPOUNDS AS PAIN RELIEVERS | MERRELL DOW PHARMACEUTICALS (US) | 1991-11-12 | — | — | US | disclosed |