Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 18/20 | 0.49 |
| ▸ | CTSB | P07858 | 14/20 | 0.49 |
| ▸ | CTSD | P07339 | 2/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3352491 | 0.89 | BACE1 (0.63) | BACE1CTSBCTSD | |
| SCHEMBL5375925 | 0.80 | BACE1 (0.41) | BACE1CTSBCTSDBACE2 | |
| SCHEMBL3350542 | 0.80 | BACE1 (0.47) | BACE1CTSBCTSD | |
| SCHEMBL3351920 | 0.80 | BACE1 (0.47) | BACE1CTSBCTSD | |
| SCHEMBL5388135 | 0.80 | BACE1 (0.41) | BACE1CTSBCTSD | |
| SCHEMBL5383729 | 0.79 | BACE1 (0.54) | BACE1CTSBCTSD | |
| SCHEMBL5377921 | 0.79 | BACE1 (0.40) | BACE1CTSBCTSDBACE2 | |
| SCHEMBL5369371 | 0.78 | BACE1 (0.58) | BACE1CTSBCTSD | |
| SCHEMBL3357093 | 0.78 | BACE1 (0.62) | BACE1CTSBCTSD | |
| SCHEMBL6700817 | 0.78 | BACE1 (0.58) | BACE1CTSBCTSD |
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 |