Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.52 |
| ▸ | CTSD | P07339 | 4/20 | 0.49 |
| ▸ | CTSB | P07858 | 11/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5371308 | 0.90 | BACE1 (0.50) | BACE1CTSDCTSBBACE2 | |
| SCHEMBL5372922 | 0.87 | BACE1 (0.49) | BACE1CTSDCTSBBACE2 | |
| SCHEMBL6699273 | 0.81 | BACE1 (0.49) | BACE1CTSDCTSBBACE2 | |
| SCHEMBL6697182 | 0.80 | BACE1 (0.49) | BACE1CTSDCTSB | |
| SCHEMBL6697214 | 0.80 | BACE1 (0.46) | BACE1CTSDCTSBBACE2 | |
| SCHEMBL5374086 | 0.80 | BACE1 (0.49) | BACE1CTSDCTSBBACE2 | |
| SCHEMBL5377569 | 0.79 | BACE1 (0.53) | BACE1CTSDCTSBBCHEBACE2 | |
| SCHEMBL5375739 | 0.77 | BACE1 (0.54) | BACE1CTSDCTSB | |
| SCHEMBL3355547 | 0.75 | BACE1 (0.65) | BACE1CTSDCTSBBCHE | |
| SCHEMBL13308177 | 0.75 | BACE1 (0.65) | BACE1CTSDCTSBBCHE |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7176242-B2 | N,N′-substituted-1,3-diamino-2-hydroxypropane derivatives | ELAN PHARMACEUTICALS, INC. (US) | 2007-02-13 | — | — | US | disclosed |