Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 17/20 | 0.63 |
| ▸ | BACE2 | Q9Y5Z0 | 3/20 | 0.63 |
| ▸ | CTSD | P07339 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL1441003 | 0.91 | BACE1 (0.54) | BACE1BACE2CTSD | |
| SCHEMBL1440516 | 0.91 | BACE1 (0.52) | BACE1BACE2CTSD | |
| SCHEMBL1441138 | 0.89 | BACE1 (0.54) | BACE1BACE2CTSD | |
| SCHEMBL1441215 | 0.88 | BACE1 (0.49) | BACE1BACE2CTSD | |
| SCHEMBL1441022 | 0.88 | BACE1 (0.52) | BACE1BACE2 | |
| SCHEMBL1441073 | 0.87 | BACE1 (0.52) | BACE1BACE2CTSD | |
| SCHEMBL1442061 | 0.87 | BACE1 (0.67) | BACE1BACE2CTSD | |
| SCHEMBL1440658 | 0.87 | BACE1 (0.67) | BACE1BACE2CTSD | |
| SCHEMBL1441242 | 0.86 | BACE1 (0.50) | BACE1BACE2 | |
| SCHEMBL1440706 | 0.84 | BACE1 (0.58) | BACE1BACE2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011029803-A1 | 2 -AMINODIHYDRO [1, 3] THIAZINES AS BACE 2 INHIBITORS FOR THE TREATMENT OF DIABETES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-03-17 | — | — | WO | claimed |
| WO-2011029803-A1 | 2 -AMINODIHYDRO [1, 3] THIAZINES AS BACE 2 INHIBITORS FOR THE TREATMENT OF DIABETES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-03-17 | — | — | WO | disclosed |