Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.44 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.41 |
| ▸ | CTSD | P07339 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17296553 | 1.00 | BACE1 (0.51) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL15783586 | 1.00 | BACE1 (0.51) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL17296547 | 0.93 | BACE1 (0.50) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL15783584 | 0.93 | BACE1 (0.50) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL17296552 | 0.90 | BACE1 (0.53) | BACE1KCNH2BACE2 | |
| SCHEMBL15783590 | 0.90 | BACE1 (0.53) | BACE1KCNH2BACE2 | |
| SCHEMBL15769148 | 0.90 | BACE1 (0.54) | BACE1KCNH2 | |
| SCHEMBL19868243 | 0.90 | BACE1 (0.54) | BACE1KCNH2 | |
| SCHEMBL15369963 | 0.90 | BACE1 (0.64) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL15783582 | 0.88 | BACE1 (0.57) | BACE1KCNH2BACE2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2931731-A1 | HEXAHYDROPYRANO [3,4-D][1,3]THIAZIN-2-AMINE COMPOUNDS AS INHIBITORS OF BACE1 | Pfizer Inc. (US) | 2015-10-21 | — | — | EP | disclosed |
| WO-2014091352-A1 | HEXAHYDROPYRANO [3,4-D][1,3]THIAZIN-2-AMINE COMPOUNDS AS INHIBITORS OF BACE1 | PFIZER INC. (US) | 2014-06-19 | — | — | WO | disclosed |