Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 3/20 | 0.38 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.30 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.30 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12593568 | 0.78 | BACE1 (0.37) | BACE1CTSD | |
| SCHEMBL7511486 | 0.78 | BACE1 (0.37) | BACE1CTSD | |
| SCHEMBL14104807 | 0.69 | BACE1 (0.36) | BACE1CTSDPRMT5WDR77 | |
| SCHEMBL7516539 | 0.66 | BACE1 (0.48) | BACE1CTSDPRMT5WDR77 | |
| SCHEMBL7511526 | 0.66 | BACE1 (0.48) | BACE1CTSDPRMT5WDR77 | |
| SCHEMBL7517307 | 0.65 | BACE1 (0.41) | BACE1CTSDHSD11B1PRMT5WDR77 | |
| SCHEMBL7511778 | 0.65 | BACE1 (0.39) | BACE1CTSDPRMT5WDR77 | |
| SCHEMBL7509953 | 0.65 | BACE1 (0.39) | BACE1CTSDHSD11B1PRMT5WDR77 | |
| SCHEMBL7511536 | 0.64 | BACE1 (0.41) | BACE1CTSDPRMT5WDR77 | |
| SCHEMBL7511757 | 0.63 | BACE1 (0.40) | BACE1CTSDPRMT5WDR77 |
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-2153832-B1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2016-03-09 | — | — | EP | disclosed |