Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.67 |
| ▸ | THPO | P40225 | 1/20 | 0.67 |
| ▸ | LMNA | P02545 | 3/20 | 0.66 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.66 |
| ▸ | PPARG | P37231 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7703424 | 0.88 | CYP2D6 (0.79) | CYP2D6THPOLMNAPMP22PPARG | |
| SCHEMBL7697676 | 0.83 | CYP2D6 (0.67) | CYP2D6THPOLMNAPMP22PPARG | |
| SCHEMBL6021254 | 0.80 | CYP2D6 (1.00) | CYP2D6THPOLMNAPMP22PPARG | |
| SCHEMBL12618637 | 0.80 | CYP2D6 (0.74) | CYP2D6THPOLMNAPMP22TSHR | |
| Hydrochloric Acid SCHEMBL2001258 | 0.79 | LMNA (1.00) | CYP2D6THPOLMNAPMP22TSHR | |
| SCHEMBL7860449 | 0.75 | CYP2D6 (0.67) | CYP2D6THPOLMNAPMP22TSHR | |
| SCHEMBL11835059 | 0.73 | PPARG (0.61) | CYP2D6THPOLMNAPMP22PPARG | |
| SCHEMBL8510492 | 0.73 | CYP2D6 (0.52) | CYP2D6THPOLMNAPMP22PPARG | |
| Hydrochloric Acid SCHEMBL11832653 | 0.73 | PPARG (0.61) | CYP2D6THPOLMNAPMP22PPARG | |
| Hydrochloric Acid SCHEMBL11843021 | 0.72 | PPARG (0.60) | CYP2D6THPOLMNAPMP22PPARG |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0885004-B1 | USE OF 4-PHENYL-3,6-DIHYDRO-2H-PYRIDYL DERIVATIVES AS NMDA RECEPTOR SUBTYPE BLOCKERS | HOFFMANN LA ROCHE (CH) | 2002-05-02 | — | — | EP | claimed |
| EP-0885004-A1 | USE OF 4-PHENYL-3,6-DIHYDRO-2H-PYRIDYL DERIVATIVES AS NMDA RECEPTOR SUBTYPE BLOCKERS | F.HOFFMANN-LA ROCHE AG (CH) | 1998-12-23 | — | — | EP | claimed |
| WO-1997032581-A1 | USE OF 4-PHENYL-3,6-DIHYDRO-2H-PYRIDYL DERIVATIVES AS NMDA RECEPTOR SUBTYPE BLOCKERS | F. HOFFMANN-LA ROCHE AG (CH) | 1997-09-12 | — | — | WO | claimed |
| EP-0885004-B1 | USE OF 4-PHENYL-3,6-DIHYDRO-2H-PYRIDYL DERIVATIVES AS NMDA RECEPTOR SUBTYPE BLOCKERS | HOFFMANN LA ROCHE (CH) | 2002-05-02 | — | — | EP | disclosed |
| EP-0885004-A1 | USE OF 4-PHENYL-3,6-DIHYDRO-2H-PYRIDYL DERIVATIVES AS NMDA RECEPTOR SUBTYPE BLOCKERS | F.HOFFMANN-LA ROCHE AG (CH) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997032581-A1 | USE OF 4-PHENYL-3,6-DIHYDRO-2H-PYRIDYL DERIVATIVES AS NMDA RECEPTOR SUBTYPE BLOCKERS | F. HOFFMANN-LA ROCHE AG (CH) | 1997-09-12 | — | — | WO | disclosed |