Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.56 |
| ▸ | PPARG | P37231 | 11/20 | 0.56 |
| ▸ | PPARA | Q07869 | 11/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.44 |
| ▸ | CDK9 | P50750 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7702261 | 0.95 | PPARG (0.51) | LTA4HPPARGPPARASIGMAR1MEN1 | |
| Hydrochloric Acid SCHEMBL7698166 | 0.94 | PPARG (0.50) | LTA4HPPARGPPARASIGMAR1MEN1 | |
| SCHEMBL11835059 | 0.83 | PPARG (0.61) | PPARGPPARASIGMAR1CYP2D6THPO | |
| SCHEMBL7697676 | 0.83 | CYP2D6 (0.67) | PPARGPPARAMEN1KMT2ACYP2D6 | |
| Hydrochloric Acid SCHEMBL11843021 | 0.82 | PPARG (0.60) | PPARGPPARASIGMAR1CYP2D6THPO | |
| Hydrochloric Acid SCHEMBL11832653 | 0.81 | PPARG (0.61) | PPARGPPARASIGMAR1CYP2D6THPO | |
| Hydrochloric Acid SCHEMBL11842023 | 0.80 | PPARG (0.60) | PPARGPPARASIGMAR1CYP2D6THPO | |
| SCHEMBL11837347 | 0.80 | PPARG (0.58) | LTA4HPPARGPPARASIGMAR1MEN1 | |
| Hydrochloric Acid SCHEMBL11838153 | 0.79 | PPARG (0.57) | LTA4HPPARGPPARASIGMAR1MEN1 | |
| SCHEMBL6161968 | 0.78 | PPARG (0.59) | LTA4HPPARGPPARASIGMAR1MEN1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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-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 |
| US-3951987-A | PSYCHOSEDATIVE | HOFFMANN-LA ROCHE INC. (US) | 1976-04-20 | — | — | US | disclosed |