Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 16/20 | 0.43 |
| ▸ | BACE2 | Q9Y5Z0 | 7/20 | 0.39 |
| ▸ | CTSD | P07339 | 4/20 | 0.32 |
| ▸ | REN | P00797 | 3/20 | 0.32 |
| ▸ | FNTA | P49354 | 2/20 | 0.32 |
| ▸ | FNTB | P49356 | 2/20 | 0.32 |
| ▸ | PGGT1B | P53609 | 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 | |
|---|---|---|---|---|
| SCHEMBL5374466 | 1.00 | BACE1 (0.43) | BACE1BACE2CTSDRENFNTA | |
| SCHEMBL5373639 | 0.87 | FNTA (0.42) | BACE1BACE2CTSDFNTAFNTB | |
| SCHEMBL5373646 | 0.87 | FNTA (0.42) | BACE1BACE2CTSDFNTAFNTB | |
| SCHEMBL5389034 | 0.84 | BACE1 (0.49) | BACE1BACE2CTSD | |
| SCHEMBL5381670 | 0.84 | BACE1 (0.49) | BACE1BACE2CTSD | |
| SCHEMBL6695268 | 0.81 | BACE1 (0.51) | BACE1BACE2CTSDREN | |
| SCHEMBL6695272 | 0.81 | BACE1 (0.51) | BACE1BACE2CTSDREN | |
| SCHEMBL13307688 | 0.81 | BACE1 (0.46) | BACE1BACE2CTSDREN | |
| SCHEMBL6701505 | 0.79 | BACE1 (0.49) | BACE1BACE2CTSD | |
| SCHEMBL5387696 | 0.77 | BACE1 (0.52) | BACE1BACE2CTSD |
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 |