Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 7/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL30052 | 0.83 | BACE1 (0.50) | BACE1APPTDP1L3MBTL1 | |
| SCHEMBL1464797 | 0.83 | BACE1 (0.50) | BACE1APPTDP1L3MBTL1 | |
| SCHEMBL9948211 | 0.76 | BACE1 (0.44) | BACE1APPTDP1L3MBTL1 | |
| SCHEMBL15490136 | 0.75 | BACE1 (0.37) | BACE1APPTDP1L3MBTL1 | |
| SCHEMBL31332 | 0.74 | BACE1 (0.51) | BACE1TDP1L3MBTL1 | |
| SCHEMBL9948162 | 0.73 | TDP1 (0.46) | TDP1L3MBTL1 | |
| SCHEMBL16621494 | 0.73 | BACE1 (0.47) | BACE1APP | |
| SCHEMBL1465873 | 0.72 | BACE1 (0.44) | BACE1APPTDP1L3MBTL1 | |
| SCHEMBL30467 | 0.72 | BACE1 (0.44) | BACE1APPTDP1L3MBTL1 | |
| SCHEMBL1464901 | 0.72 | BACE1 (0.44) | BACE1APPTDP1L3MBTL1 |
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 |