Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MMP8 | P22894 | 3/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL1547275 | 0.91 | HIF1A (0.44) | HIF1ASMN1; SMN2SLC6A2TAAR1CYP3A4 | |
| SCHEMBL3656311 | 0.85 | SMN1; SMN2 (0.48) | HIF1ASMN1; SMN2SLC6A2TAAR1CYP3A4 | |
| SCHEMBL7619909 | 0.81 | SLC6A2 (0.48) | HIF1ASMN1; SMN2SLC6A2TAAR1CYP3A4 | |
| SCHEMBL9049038 | 0.81 | TRPA1 (0.45) | HIF1ASMN1; SMN2SLC6A2TAAR1CYP3A4 | |
| SCHEMBL476211 | 0.80 | PPARG (0.46) | HIF1ASMN1; SMN2SLC6A2TAAR1CYP3A4 | |
| SCHEMBL15224723 | 0.79 | ALDH1A1 (0.38) | HIF1ASMN1; SMN2SLC6A2TAAR1CYP3A4 | |
| SCHEMBL2641207 | 0.78 | PPARG (0.44) | HIF1ASMN1; SMN2SLC6A2TAAR1CYP3A4 | |
| SCHEMBL28332881 | 0.78 | LMNA (0.45) | HIF1ASMN1; SMN2CYP3A4LMNAPPARA | |
| SCHEMBL28845778 | 0.77 | ALDH1A1 (0.43) | HIF1ASMN1; SMN2SLC6A2TAAR1CYP3A4 | |
| SCHEMBL6488586 | 0.77 | CYP3A4 (0.46) | HIF1ASMN1; SMN2SLC6A2TAAR1CYP3A4 |
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-0349063-B1 | 5-oxygenated HMG-COA reductase inhibitors | MERCK & CO INC (US) | 1995-09-13 | — | — | EP | disclosed |
| US-5130306-A | Enzyme inhibitors and anticholesterol agents | MERCK & CO., INC. (US) | 1992-07-14 | — | — | US | disclosed |
| US-4963538-A | ANTICHOLESTEROL AGENT | MERCK & CO., INC. (US) | 1990-10-16 | — | — | US | disclosed |
| EP-0349063-A2 | 5-oxygenated HMG-COA reductase inhibitors | MERCK & CO. INC. (US) | 1990-01-03 | — | — | EP | disclosed |