Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.36 |
| ▸ | VNN1 | O95497 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1376718 | 0.85 | CYP3A4 (0.46) | CYP3A4CYP3A5CYP11B2KDM4EALDH1A1 | |
| SCHEMBL1378190 | 0.84 | CYP3A4 (0.45) | CYP3A4CYP3A5CYP11B2KDM4EALDH1A1 | |
| SCHEMBL1379806 | 0.78 | ALDH1A1 (0.43) | CYP3A4CYP3A5CYP11B2KDM4EALDH1A1 | |
| SCHEMBL2354106 | 0.71 | CYP3A4 (0.67) | CYP3A4CYP3A5CYP11B2ALDH1A1CYP19A1 | |
| SCHEMBL1375862 | 0.71 | L3MBTL1 (0.34) | CYP3A4CYP1A2CYP2C9CYP2C19CYP19A1 | |
| SCHEMBL1380149 | 0.70 | CYP3A4 (0.35) | CYP3A4CYP3A5CYP11B2KDM4EALDH1A1 | |
| SCHEMBL4197311 | 0.68 | CYP19A1 (0.44) | CYP3A4CYP11B2CYP1A2CYP19A1KCNA5 | |
| SCHEMBL1378123 | 0.67 | TSHR (0.43) | CYP3A4ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9165118 | 0.67 | CYP19A1 (0.62) | CYP3A4CYP3A5CYP11B2CYP19A1CYP11B1 | |
| SCHEMBL3890051 | 0.67 | LOXL2 (0.52) | ALDH1A1CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-4719745-B2 | — | — | 2011-07-06 | — | — | JP | claimed |
| EP-1781635-A4 | POTASSIUM CHANNEL INHIBITORS | MERCK & CO INC (US) | 2009-02-25 | — | — | EP | claimed |
| EP-1781635-A2 | POTASSIUM CHANNEL INHIBITORS | Merck & Co., Inc. (US) | 2007-05-09 | — | — | EP | claimed |
| WO-2006015159-A2 | POTASSIUM CHANNEL INHIBITORS | MERCK & CO., INC. (US) | 2006-02-09 | — | — | WO | claimed |