Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | CNR1 | P21554 | 2/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.41 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9509183 | 1.00 | MEN1 (0.58) | MEN1CYP1A2MAPTTSHRKMT2A | |
| SCHEMBL9509106 | 0.85 | MEN1 (0.58) | MEN1CYP1A2MAPTTSHRKMT2A | |
| SCHEMBL9508091 | 0.84 | MEN1 (0.57) | MEN1CYP1A2MAPTTSHRKMT2A | |
| SCHEMBL9508098 | 0.83 | MEN1 (0.58) | MEN1CYP1A2MAPTTSHRKMT2A | |
| SCHEMBL9507028 | 0.81 | PPARA (0.55) | CNR1CNR2CYSLTR2CYSLTR1 | |
| SCHEMBL9506988 | 0.81 | PPARA (0.55) | CNR1CNR2CYSLTR2CYSLTR1 | |
| SCHEMBL9579679 | 0.81 | CYSLTR2 (0.62) | MEN1CYP1A2MAPTTSHRKMT2A | |
| SCHEMBL9510571 | 0.80 | MEN1 (0.57) | MEN1CYP1A2MAPTTSHRKMT2A | |
| SCHEMBL5050181 | 0.79 | CYP1A2 (0.67) | MEN1CYP1A2MAPTTSHRKMT2A | |
| SCHEMBL10750616 | 0.76 | MEN1 (0.55) | MEN1CYP1A2MAPTTSHRKMT2A |
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-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 | claimed |
| 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 |