Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.74 |
| ▸ | CTSB | P07858 | 19/20 | 0.74 |
| ▸ | CTSD | P07339 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5579818 | 1.00 | BACE1 (0.74) | BACE1CTSBCTSD | |
| SCHEMBL5579821 | 1.00 | BACE1 (0.74) | BACE1CTSBCTSD | |
| SCHEMBL5580028 | 0.93 | BACE1 (0.73) | BACE1CTSBCTSD | |
| SCHEMBL5579765 | 0.90 | CTSB (0.71) | BACE1CTSB | |
| SCHEMBL5579761 | 0.90 | CTSB (0.71) | BACE1CTSB | |
| SCHEMBL5579758 | 0.90 | CTSB (0.71) | BACE1CTSB | |
| SCHEMBL5579934 | 0.90 | CTSB (0.74) | BACE1CTSB | |
| SCHEMBL5139719 | 0.88 | BACE1 (0.61) | BACE1CTSBCTSD | |
| SCHEMBL5579794 | 0.88 | CTSB (0.58) | BACE1CTSB | |
| SCHEMBL5126832 | 0.87 | BACE1 (0.61) | 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 |