Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 18/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CTSD | P07339 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL296981 | 0.77 | BACE1 (0.44) | BACE1TSHRCTSD | |
| SCHEMBL286922 | 0.74 | BACE1 (0.43) | BACE1TSHRCTSD | |
| SCHEMBL298012 | 0.73 | BACE1 (0.45) | BACE1CTSD | |
| SCHEMBL2884768 | 0.73 | BACE1 (0.50) | BACE1CTSD | |
| SCHEMBL2884764 | 0.73 | BACE1 (0.50) | BACE1CTSD | |
| SCHEMBL2888618 | 0.69 | BACE1 (0.66) | BACE1CTSD | |
| SCHEMBL2888615 | 0.69 | BACE1 (0.66) | BACE1CTSD | |
| SCHEMBL4136953 | 0.66 | BACE1 (0.68) | BACE1 | |
| SCHEMBL4146758 | 0.65 | BACE1 (0.67) | BACE1 | |
| SCHEMBL4151148 | 0.63 | BACE1 (0.63) | BACE1CTSD |
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-2427437-A1 | DIHYDROPYRIMIDINONES FOR USE AS BACE2 INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2012-03-14 | — | — | EP | disclosed |