Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | PLA2G4B | P0C869 | 3/20 | 0.52 |
| ▸ | IGF1R | P08069 | 3/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | APP | P05067 | 2/20 | 0.50 |
| ▸ | YWHAG | P61981 | 1/20 | 0.50 |
| ▸ | LCK | P06239 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.49 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.48 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | RARB | P10826 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9506788 | 0.94 | PLA2G4B (0.60) | PKMPLA2G4BIGF1RALOX15TP53 | |
| SCHEMBL10412008 | 0.86 | CYSLTR1 (0.54) | PLA2G4BIGF1RALOX15APPYWHAG | |
| SCHEMBL9558671 | 0.85 | PLA2G4B (0.55) | PKMPLA2G4BTP53TSHRALDH1A1 | |
| SCHEMBL10412747 | 0.84 | CYSLTR1 (0.57) | PLA2G4BIGF1RALOX15APPYWHAG | |
| SCHEMBL9557988 | 0.83 | PLA2G4B (0.57) | PLA2G4BTP53TSHRHTTRARB | |
| SCHEMBL9506806 | 0.81 | KMT2A (0.56) | PLA2G4BIGF1RALOX15 | |
| SCHEMBL7774931 | 0.81 | PKM (0.68) | PKMPLA2G4BFFAR1 | |
| SCHEMBL4361279 | 0.80 | PLA2G4B (0.76) | PKMPLA2G4BTP53TSHRFFAR1 | |
| SCHEMBL14966915 | 0.80 | PKM (0.71) | PKMPLA2G4BTP53TSHRFFAR1 | |
| SCHEMBL9507025 | 0.79 | LCK (0.61) | IGF1RALOX15APPYWHAGLCK |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0310126-B1 | DERIVATIVES OF PYROCATECHOL-CARBOXYLIC ACID, THEIR PREPARATION AND USE AS ACTIVE INGREDIENTS IN MEDICINES | F. HOFFMANN-LA ROCHE AG (CH) | 1993-08-18 | — | — | EP | disclosed |
| US-5191108-A | Lipoxygenase inhibitors, antiinflammatory agents | HOFFMANN-LA ROCHE INC. (US) | 1993-03-02 | — | — | US | disclosed |
| US-5025036-A | Antiinflammatory agents, gastrointestinal, cardiovascular and skin disorders | HOFFMANN-LA ROCHE INC. (US) | 1991-06-18 | — | — | US | disclosed |
| EP-0310126-A2 | Derivatives of pyrocatechol-carboxylic acid, their preparation and use as active ingredients in medicines | F. HOFFMANN-LA ROCHE AG (CH) | 1989-04-05 | — | — | EP | disclosed |