Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 17/20 | 0.69 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.69 |
| ▸ | BACE2 | Q9Y5Z0 | 7/20 | 0.63 |
| ▸ | CTSD | P07339 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL3305138 | 0.89 | BACE1 (0.83) | BACE1KCNH2CYP2D6BACE2CTSD | |
| SCHEMBL3305132 | 0.89 | BACE1 (0.83) | BACE1KCNH2CYP2D6BACE2CTSD | |
| SCHEMBL16664339 | 0.88 | BACE1 (0.64) | BACE1KCNH2CYP2D6BACE2 | |
| SCHEMBL2108804 | 0.87 | BACE1 (0.81) | BACE1KCNH2CYP2D6BACE2CTSD | |
| SCHEMBL2108807 | 0.87 | BACE1 (0.81) | BACE1KCNH2CYP2D6BACE2CTSD | |
| SCHEMBL3301930 | 0.86 | BACE1 (0.82) | BACE1KCNH2CYP2D6BACE2 | |
| SCHEMBL3301926 | 0.86 | BACE1 (0.82) | BACE1KCNH2CYP2D6BACE2 | |
| SCHEMBL8031009 | 0.83 | BACE1 (0.81) | BACE1KCNH2CYP2D6BACE2CTSD | |
| SCHEMBL2620223 | 0.83 | BACE1 (0.81) | BACE1KCNH2CYP2D6BACE2CTSD | |
| SCHEMBL2930052 | 0.83 | BACE1 (0.81) | BACE1KCNH2CYP2D6BACE2CTSD |
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 |