Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.79 |
| ▸ | THPO | P40225 | 1/20 | 0.79 |
| ▸ | LMNA | P02545 | 2/20 | 0.77 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.77 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6021254 | 0.88 | CYP2D6 (1.00) | CYP2D6THPOLMNAPMP22TSHR | |
| SCHEMBL7702263 | 0.88 | CYP2D6 (0.67) | CYP2D6THPOLMNAPMP22KCNH2 | |
| Hydrochloric Acid SCHEMBL2001258 | 0.87 | LMNA (1.00) | CYP2D6THPOLMNAPMP22TSHR | |
| SCHEMBL7697676 | 0.85 | CYP2D6 (0.67) | CYP2D6THPOLMNAPMP22KCNH2 | |
| SCHEMBL7860449 | 0.84 | CYP2D6 (0.67) | CYP2D6THPOLMNAPMP22KCNH2 | |
| SCHEMBL12618637 | 0.83 | CYP2D6 (0.74) | CYP2D6THPOLMNAPMP22TSHR | |
| SCHEMBL2017339 | 0.81 | KCNH2 (0.81) | LMNAKCNH2MAPTABCB1CACNA1G | |
| SCHEMBL2017338 | 0.81 | KCNH2 (0.81) | LMNAKCNH2MAPTABCB1CACNA1G | |
| SCHEMBL2024028 | 0.81 | KCNH2 (0.81) | LMNAKCNH2MAPTABCB1CACNA1G | |
| SCHEMBL7861690 | 0.79 | CYP2D6 (0.71) | CYP2D6THPOLMNAPMP22TSHR |
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 |