Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 19/20 | 0.44 |
| ▸ | CTSD | P07339 | 7/20 | 0.41 |
| ▸ | BACE2 | Q9Y5Z0 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5579958 | 1.00 | BACE1 (0.44) | BACE1CTSDBACE2 | |
| Hydrochloric Acid SCHEMBL5117295 | 0.99 | BACE1 (0.44) | BACE1CTSDBACE2 | |
| Hydrochloric Acid SCHEMBL5118346 | 0.99 | BACE1 (0.44) | BACE1CTSDBACE2 | |
| SCHEMBL5124283 | 0.93 | BACE1 (0.43) | BACE1CTSDBACE2 | |
| SCHEMBL5124290 | 0.93 | BACE1 (0.43) | BACE1CTSDBACE2 | |
| SCHEMBL14131373 | 0.87 | BACE1 (0.53) | BACE1CTSDBACE2 | |
| SCHEMBL5579784 | 0.87 | BACE1 (0.44) | BACE1CTSDBACE2 | |
| SCHEMBL5130399 | 0.87 | BACE1 (0.44) | BACE1CTSDBACE2 | |
| Hydrochloric Acid SCHEMBL5118534 | 0.86 | BACE1 (0.52) | BACE1CTSDBACE2 | |
| Hydrochloric Acid SCHEMBL5117880 | 0.86 | BACE1 (0.52) | BACE1CTSDBACE2 |
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-7294642-B2 | 1,3-Diamino-2-hydroxypropane pro-drug derivatives | ELAN PHARMACEUTICALS, INC. (US) | 2007-11-13 | — | — | US | claimed |