Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 16/20 | 0.78 |
| ▸ | BACE2 | Q9Y5Z0 | 13/20 | 0.78 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL1935585 | 1.00 | BACE1 (0.78) | BACE1BACE2KCNH2CYP2D6 | |
| SCHEMBL3301702 | 0.93 | BACE1 (0.68) | BACE1BACE2KCNH2CYP2D6 | |
| SCHEMBL3301697 | 0.93 | BACE1 (0.68) | BACE1BACE2KCNH2CYP2D6 | |
| SCHEMBL3299913 | 0.92 | BACE1 (0.78) | BACE1BACE2KCNH2CYP2D6 | |
| SCHEMBL3299922 | 0.92 | BACE1 (0.78) | BACE1BACE2KCNH2CYP2D6 | |
| SCHEMBL16664339 | 0.91 | BACE1 (0.64) | BACE1BACE2KCNH2CYP2D6 | |
| SCHEMBL3304352 | 0.91 | BACE1 (0.73) | BACE1BACE2KCNH2CYP2D6 | |
| SCHEMBL3304350 | 0.91 | BACE1 (0.73) | BACE1BACE2KCNH2CYP2D6 | |
| SCHEMBL2108254 | 0.90 | BACE1 (0.67) | BACE1BACE2KCNH2CYP2D6 | |
| SCHEMBL2108256 | 0.90 | BACE1 (0.67) | BACE1BACE2KCNH2CYP2D6 |
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-2332943-B1 | NOVEL FUSED AMINODIHYDROTHIAZINE DERIVATIVE | EISAI R&D MAN CO LTD (JP) | 2015-04-22 | — | — | EP | disclosed |