Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.30 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.30 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.30 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.30 |
| ▸ | ABL1 | P00519 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31331 | 0.86 | BACE1 (0.67) | BACE1TDP1L3MBTL1PDE4BGABRA1 | |
| SCHEMBL17679176 | 0.82 | BACE1 (0.51) | BACE1TDP1L3MBTL1PDE4BGABRA1 | |
| SCHEMBL17679174 | 0.82 | BACE1 (0.51) | BACE1TDP1L3MBTL1PDE4BGABRA1 | |
| SCHEMBL30571 | 0.74 | BACE1 (0.38) | BACE1TDP1L3MBTL1 | |
| SCHEMBL30562 | 0.73 | BACE1 (0.49) | BACE1 | |
| SCHEMBL7887442 | 0.73 | BACE1 (0.41) | BACE1TDP1L3MBTL1PDE4BGABRA1 | |
| SCHEMBL19530377 | 0.72 | BACE1 (0.41) | BACE1PDE4B | |
| SCHEMBL19530378 | 0.72 | BACE1 (0.41) | BACE1PDE4B | |
| SCHEMBL19514306 | 0.71 | BACE1 (0.40) | BACE1PDE4B | |
| SCHEMBL19514301 | 0.71 | BACE1 (0.40) | BACE1PDE4B |
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 |