Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ6 | P48051 | 2/20 | 0.35 |
| ▸ | KCNJ3 | P48549 | 2/20 | 0.35 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 4/20 | 0.34 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.34 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | PLD2 | O14939 | 4/20 | 0.33 |
| ▸ | PLD1 | Q13393 | 4/20 | 0.33 |
| ▸ | MMP2 | P08253 | 2/20 | 0.32 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3479619 | 1.00 | KCNJ6 (0.35) | KCNJ6KCNJ3KCNJ5BACE1BACE2 | |
| SCHEMBL5326122 | 0.88 | ADORA3 (0.39) | BACE1BACE2KMT2ALMNAALDH1A1 | |
| SCHEMBL3893080 | 0.87 | MAPK14 (0.39) | KCNJ6KCNJ3KCNJ5BACE1BACE2 | |
| SCHEMBL3479516 | 0.87 | MAPK14 (0.39) | KCNJ6KCNJ3KCNJ5BACE1BACE2 | |
| SCHEMBL756120 | 0.86 | PDK1 (0.38) | BACE1METAP2 | |
| SCHEMBL3887599 | 0.86 | HPGDS (0.34) | KCNJ6KCNJ3KCNJ5BACE1BACE2 | |
| SCHEMBL3492314 | 0.86 | HPGDS (0.34) | KCNJ6KCNJ3KCNJ5BACE1BACE2 | |
| SCHEMBL5616293 | 0.85 | BACE1 (0.35) | KCNJ6KCNJ3KCNJ5BACE1BACE2 | |
| SCHEMBL5616430 | 0.85 | BACE1 (0.35) | KCNJ6KCNJ3KCNJ5BACE1BACE2 | |
| SCHEMBL594592 | 0.84 | CYP3A4 (0.41) | KCNJ6KCNJ3KCNJ5ENPP2CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2063889-A2 | SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | Merck & Co., Inc. (US) | 2009-06-03 | — | — | EP | disclosed |
| WO-2008030412-A2 | SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK & CO., INC. (US) | 2008-03-13 | — | — | WO | disclosed |