Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.40 |
| ▸ | CTSB | P07858 | 17/20 | 0.40 |
| ▸ | CTSD | P07339 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5579560 | 1.00 | BACE1 (0.40) | BACE1CTSBCTSD | |
| SCHEMBL5124411 | 0.87 | KMT2A (0.42) | BACE1CTSBCTSD | |
| SCHEMBL5124419 | 0.87 | KMT2A (0.42) | BACE1CTSBCTSD | |
| SCHEMBL5580063 | 0.85 | GRM5 (0.41) | BACE1CTSBCTSD | |
| SCHEMBL5125220 | 0.85 | BACE1 (0.46) | BACE1CTSBCTSD | |
| SCHEMBL5125218 | 0.85 | BACE1 (0.46) | BACE1CTSBCTSD | |
| SCHEMBL5130252 | 0.85 | BACE1 (0.41) | BACE1CTSBCTSD | |
| SCHEMBL5125830 | 0.85 | BACE1 (0.41) | BACE1CTSBCTSD | |
| SCHEMBL5125843 | 0.85 | BACE1 (0.41) | BACE1CTSBCTSD | |
| SCHEMBL5130247 | 0.85 | BACE1 (0.41) | 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-7294642-B2 | 1,3-Diamino-2-hydroxypropane pro-drug derivatives | ELAN PHARMACEUTICALS, INC. (US) | 2007-11-13 | — | — | US | claimed |