Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 15/20 | 0.43 |
| ▸ | CTSD | P07339 | 9/20 | 0.43 |
| ▸ | BCHE | P06276 | 3/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3347371 | 0.87 | BACE1 (0.45) | BACE1CTSDBACE2 | |
| SCHEMBL3351421 | 0.86 | BACE1 (0.47) | BACE1CTSDBACE2 | |
| SCHEMBL3349771 | 0.86 | BACE1 (0.45) | BACE1CTSDBACE2 | |
| SCHEMBL3348139 | 0.85 | BACE1 (0.43) | BACE1CTSDBACE2 | |
| SCHEMBL3351487 | 0.85 | BACE1 (0.45) | BACE1CTSDBACE2 | |
| SCHEMBL3351399 | 0.84 | BACE1 (0.44) | BACE1CTSDBACE2 | |
| SCHEMBL3351667 | 0.84 | BACE1 (0.44) | BACE1CTSDBACE2 | |
| SCHEMBL3350577 | 0.84 | BACE1 (0.43) | BACE1CTSDBACE2 | |
| SCHEMBL3348246 | 0.83 | BACE1 (0.53) | BACE1CTSDBCHE | |
| SCHEMBL3349119 | 0.83 | BACE1 (0.46) | BACE1CTSDBCHEBACE2 |
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 |