Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.79 |
| ▸ | CTSB | P07858 | 19/20 | 0.79 |
| ▸ | CTSD | P07339 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL5645966 | 0.91 | BACE1 (0.78) | BACE1CTSBCTSD | |
| SCHEMBL14348040 | 0.91 | BACE1 (0.78) | BACE1CTSBCTSD | |
| SCHEMBL14348042 | 0.91 | BACE1 (0.78) | BACE1CTSBCTSD | |
| SCHEMBL14347930 | 0.90 | CTSB (0.84) | BACE1CTSB | |
| Hydrochloric Acid SCHEMBL4666330 | 0.90 | BACE1 (0.76) | BACE1CTSBCTSD | |
| Hydrochloric Acid SCHEMBL6708069 | 0.90 | CTSB (0.83) | BACE1CTSB | |
| SCHEMBL6685299 | 0.90 | CTSB (0.85) | BACE1CTSB | |
| SCHEMBL14347932 | 0.90 | CTSB (0.85) | BACE1CTSB | |
| SCHEMBL14201300 | 0.90 | CTSB (0.75) | BACE1CTSB | |
| SCHEMBL14347931 | 0.89 | CTSB (0.84) | BACE1CTSB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1395551-B1 | HYDROXY ALKYL AMINE DERIVATIVES AS BETA-SECRETASE INHIBITORS AND THEIR USE FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND SIMILAR DISEASES | ELAN PHARM INC (US) | 2008-05-21 | — | — | EP | disclosed |