Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 18/20 | 0.53 |
| ▸ | PPARG | P37231 | 18/20 | 0.48 |
| ▸ | PPARD | Q03181 | 18/20 | 0.48 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.46 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7038827 | 0.84 | PPARA (0.46) | PPARAPPARGPPARDNR1H2NR1H3 | |
| SCHEMBL9118750 | 0.76 | MAOB (0.47) | PPARAPPARGPPARD | |
| SCHEMBL27656755 | 0.69 | KDM4E (0.46) | — | |
| SCHEMBL10972521 | 0.69 | PDE5A (0.55) | PPARAPPARGPPARD | |
| SCHEMBL11360555 | 0.69 | PDE5A (0.38) | PPARAPPARGPPARD | |
| SCHEMBL7038001 | 0.69 | MAPK14 (0.38) | — | |
| SCHEMBL10972035 | 0.69 | PDE5A (0.52) | PPARAPPARGPPARD | |
| SCHEMBL6561528 | 0.69 | KDM4E (0.49) | NR1H2NR1H3 | |
| SCHEMBL9121837 | 0.69 | LMNA (0.48) | — | |
| SCHEMBL10959657 | 0.68 | ERN1 (0.48) | — |
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-0882029-B1 | HETEROCYCLIC DERIVATIVES AS ANTIDIABETIC AND ANTIOBESITY AGENTS | MERCK & CO INC (US) | 2003-04-02 | — | — | EP | disclosed |
| US-6090836-A | DIETETICS; ADJUSTMENT OF TRIGLYCERIDE CONCENTRATION | MERCK & CO., INC. (US) | 2000-07-18 | — | — | US | disclosed |
| EP-0882029-A1 | HETEROCYCLIC DERIVATIVES AS ANTIDIABETIC AND ANTIOBESITY AGENTS | Merck & Co., Inc. (US) | 1998-12-09 | — | — | EP | disclosed |
| WO-1997028137-A1 | HETEROCYCLIC DERIVATIVES AS ANTIDIABETIC AND ANTIOBESITY AGENTS | MERCK & CO., INC. (US) | 1997-08-07 | — | — | WO | disclosed |