Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.51 |
| ▸ | BACE2 | Q9Y5Z0 | 9/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL8267093 | 0.90 | BACE1 (0.44) | BACE1BACE2 | |
| SCHEMBL4556675 | 0.89 | BACE1 (0.59) | BACE1BACE2KCNH2 | |
| SCHEMBL7543798 | 0.89 | BACE1 (0.59) | BACE1BACE2KCNH2 | |
| SCHEMBL7539382 | 0.88 | BACE1 (0.60) | BACE1BACE2 | |
| SCHEMBL14105194 | 0.88 | BACE1 (0.46) | BACE1BACE2 | |
| SCHEMBL7557654 | 0.88 | BACE1 (0.46) | BACE1BACE2KCNH2 | |
| SCHEMBL7537582 | 0.88 | BACE1 (0.46) | BACE1BACE2KCNH2 | |
| SCHEMBL7569960 | 0.88 | BACE1 (0.46) | BACE1BACE2KCNH2 | |
| SCHEMBL7560497 | 0.88 | BACE1 (0.60) | BACE1BACE2KCNH2 | |
| SCHEMBL7537447 | 0.88 | BACE1 (0.60) | BACE1BACE2KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006065277-A2 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | SCHERING CORPORATION (US) | 2006-06-22 | — | — | WO | disclosed |