Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 19/20 | 0.74 |
| ▸ | PPARG | P37231 | 18/20 | 0.74 |
| ▸ | PPARD | Q03181 | 18/20 | 0.74 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.61 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL7041196 | 0.90 | PPARA (0.61) | PPARAPPARGPPARDNR1H2NR1H3 | |
| SCHEMBL7041508 | 0.89 | PPARG (0.75) | PPARAPPARGPPARDNR1H2NR1H3 | |
| SCHEMBL7107505 | 0.86 | PPARA (0.76) | PPARAPPARGPPARDNR1H2NR1H3 | |
| SCHEMBL7043426 | 0.86 | PPARA (0.60) | PPARAPPARGPPARDNR1H2NR1H3 | |
| SCHEMBL7040699 | 0.86 | PPARA (0.57) | PPARAPPARGPPARDNR1H2NR1H3 | |
| SCHEMBL7038856 | 0.85 | PPARA (1.00) | PPARAPPARGPPARD | |
| SCHEMBL7039064 | 0.83 | PPARD (0.58) | PPARAPPARGPPARDNR1H2NR1H3 | |
| SCHEMBL7041543 | 0.83 | GRM2 (0.52) | PPARAPPARGPPARDNR1H2NR1H3 | |
| SCHEMBL7042325 | 0.82 | PPARD (0.65) | PPARAPPARGPPARDNR1H2NR1H3 | |
| SCHEMBL7046175 | 0.82 | PPARD (0.64) | PPARAPPARGPPARDNR1H2NR1H3 |
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 8 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 | claimed |
| US-6090836-A | DIETETICS; ADJUSTMENT OF TRIGLYCERIDE CONCENTRATION | MERCK & CO., INC. (US) | 2000-07-18 | — | — | US | claimed |
| EP-0882029-A1 | HETEROCYCLIC DERIVATIVES AS ANTIDIABETIC AND ANTIOBESITY AGENTS | Merck & Co., Inc. (US) | 1998-12-09 | — | — | EP | claimed |
| WO-1997028137-A1 | HETEROCYCLIC DERIVATIVES AS ANTIDIABETIC AND ANTIOBESITY AGENTS | MERCK & CO., INC. (US) | 1997-08-07 | — | — | WO | claimed |
| 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 |