Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 10/20 | 0.38 |
| ▸ | PGR | P06401 | 7/20 | 0.36 |
| ▸ | OTUD7B | Q6GQQ9 | 3/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7890834 | 1.00 | BACE1 (0.38) | BACE1PGROTUD7BAR | |
| SCHEMBL7885367 | 0.86 | BACE1 (0.49) | BACE1PGROTUD7BAR | |
| SCHEMBL7888002 | 0.84 | BACE1 (0.37) | BACE1PGROTUD7BAR | |
| SCHEMBL1464566 | 0.83 | BACE1 (0.47) | BACE1PGROTUD7B | |
| SCHEMBL7888593 | 0.83 | BACE1 (0.47) | BACE1PGROTUD7B | |
| SCHEMBL1464568 | 0.83 | BACE1 (0.47) | BACE1PGROTUD7B | |
| SCHEMBL1465070 | 0.81 | BACE1 (0.49) | BACE1PGROTUD7BAR | |
| SCHEMBL1465073 | 0.81 | BACE1 (0.49) | BACE1PGROTUD7BAR | |
| SCHEMBL1465230 | 0.79 | BACE1 (0.45) | BACE1PGROTUD7B | |
| SCHEMBL1465232 | 0.79 | BACE1 (0.45) | BACE1PGROTUD7B |
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-2406240-A2 | INHIBITORS OF BETA-SECRETASE | Vitae Pharmaceuticals, Inc. (US) | 2012-01-18 | — | — | EP | disclosed |
| WO-2010105179-A2 | INHIBITORS OF BETA-SECRETASE | VITAE PHARMACEUTICALS, INC. (US) | 2010-09-16 | — | — | WO | disclosed |