Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30087171 | 0.87 | LMNA (0.60) | PTGS2LMNAALDH1A1KDM4EHSD17B10 | |
| SCHEMBL11528338 | 0.85 | NPC1 (0.49) | LMNAALDH1A1KMT2AMEN1MCL1 | |
| SCHEMBL7486777 | 0.84 | HPGD (0.56) | LMNAALDH1A1KDM4EHSD17B10KMT2A | |
| SCHEMBL2354770 | 0.83 | PTGS2 (0.52) | PTGS2LMNALPAR2ALDH1A1KDM4E | |
| SCHEMBL5522283 | 0.82 | ALDH1A1 (0.55) | PTGS2ALDH1A1KDM4EHSD17B10KMT2A | |
| SCHEMBL13116437 | 0.81 | LMNA (0.57) | PTGS2LMNAALDH1A1KDM4EHSD17B10 | |
| SCHEMBL7682886 | 0.80 | PTGS2 (0.54) | PTGS2LMNAALDH1A1KDM4EHSD17B10 | |
| SCHEMBL21618362 | 0.79 | ATF4 (0.53) | PTGS2LMNAALDH1A1KDM4EHSD17B10 | |
| SCHEMBL534024 | 0.79 | PTGS2 (0.52) | PTGS2LMNAALDH1A1KDM4EHSD17B10 | |
| SCHEMBL16898011 | 0.79 | CA12 (0.56) | PTGS2LMNAALDH1A1KDM4EHSD17B10 |
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 |