Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | BACE2 | Q9Y5Z0 | 3/20 | 0.42 |
| ▸ | CTSD | P07339 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19218181 | 1.00 | BACE1 (0.61) | BACE1CYP2D6KCNH2BACE2CTSD | |
| SCHEMBL12557551 | 0.91 | BACE1 (0.61) | BACE1CYP2D6KCNH2 | |
| SCHEMBL3302977 | 0.86 | BACE1 (0.48) | BACE1CYP2D6KCNH2BACE2CTSD | |
| SCHEMBL3302981 | 0.86 | BACE1 (0.48) | BACE1CYP2D6KCNH2BACE2CTSD | |
| SCHEMBL15839962 | 0.85 | BACE1 (0.64) | BACE1CYP2D6KCNH2BACE2CTSD | |
| SCHEMBL15370009 | 0.85 | BACE1 (0.43) | BACE1CYP2D6KCNH2BACE2CTSD | |
| SCHEMBL15839805 | 0.84 | BACE1 (0.63) | BACE1CYP2D6KCNH2BACE2CTSD | |
| SCHEMBL15369977 | 0.84 | BACE1 (0.50) | BACE1CYP2D6KCNH2BACE2CTSD | |
| SCHEMBL15940412 | 0.84 | BACE1 (0.50) | BACE1CYP2D6KCNH2BACE2CTSD | |
| SCHEMBL15630253 | 0.84 | BACE1 (0.63) | BACE1KCNH2BACE2CTSD |
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-2956459-B1 | SUBSTITUTED PHENYL-HEXAHYDROPYRANO[3,4-D][1,3]THIAZIN-2-AMINE COMPOUNDS | PFIZER (US) | 2017-07-19 | — | — | EP | disclosed |
| WO-2014125397-A1 | SUBSTITUTED PHENYL HEXAHYDROPYRANO[3,4-d][1,3]THIAZIN-2-AMINE COMPOUNDS | PFIZER INC. (US) | 2014-08-21 | — | — | WO | disclosed |