Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.72 |
| ▸ | CTSD | P07339 | 8/20 | 0.59 |
| ▸ | BCHE | P06276 | 2/20 | 0.58 |
| ▸ | CTSB | P07858 | 4/20 | 0.52 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13306181 | 1.00 | BACE1 (0.72) | BACE1CTSDBCHECTSBBACE2 | |
| SCHEMBL13306696 | 1.00 | BACE1 (0.72) | BACE1CTSDBCHECTSBBACE2 | |
| SCHEMBL716159 | 0.92 | BACE1 (0.69) | BACE1CTSDBCHEBACE2 | |
| SCHEMBL715055 | 0.92 | BACE1 (0.69) | BACE1CTSDBCHEBACE2 | |
| SCHEMBL3355052 | 0.91 | BACE1 (0.68) | BACE1CTSDCTSB | |
| SCHEMBL13306616 | 0.91 | BACE1 (0.68) | BACE1CTSDCTSB | |
| SCHEMBL13307641 | 0.91 | BACE1 (0.68) | BACE1CTSDCTSB | |
| SCHEMBL13334080 | 0.89 | BACE1 (0.66) | BACE1CTSDCTSBBACE2 | |
| SCHEMBL3349885 | 0.88 | BACE1 (0.65) | BACE1CTSDBCHECTSBBACE2 | |
| SCHEMBL14201296 | 0.88 | BACE1 (0.68) | BACE1CTSDCTSBBACE2 |
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-2009027601-A2 | PYRAZOLE 3,5 CARBOXYLATE DERIVATIVES PREPARATION AND THERAPEUTIC APPLICATION THEREOF | SANOFI-AVENTIS (FR) | 2009-03-05 | — | — | WO | disclosed |