Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 9/20 | 0.58 |
| ▸ | CTSD | P07339 | 1/20 | 0.48 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9913311 | 1.00 | BACE1 (0.67) | BACE1KCNH2CTSDBACE2CYP2D6 | |
| SCHEMBL15630253 | 0.91 | BACE1 (0.63) | BACE1KCNH2CTSDBACE2 | |
| SCHEMBL15783612 | 0.87 | BACE1 (0.65) | BACE1KCNH2BACE2CYP2D6 | |
| SCHEMBL9913407 | 0.86 | BACE1 (0.66) | BACE1KCNH2BACE2 | |
| SCHEMBL7918276 | 0.86 | BACE1 (0.66) | BACE1KCNH2BACE2 | |
| SCHEMBL2926633 | 0.85 | BACE1 (0.50) | BACE1KCNH2BACE2 | |
| SCHEMBL2631627 | 0.85 | BACE1 (0.50) | BACE1KCNH2BACE2 | |
| SCHEMBL11888094 | 0.85 | BACE1 (0.50) | BACE1KCNH2BACE2 | |
| SCHEMBL2632312 | 0.85 | BACE1 (0.50) | BACE1KCNH2BACE2 | |
| SCHEMBL2619830 | 0.84 | BACE1 (0.47) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010038686-A1 | NOVEL FUSED AMINODIHYDROTHIAZINE DERIVATIVE | エーザイ・アール・アンド・ディー・マネジメント株式会社 (JP) | 2010-04-08 | — | — | WO | disclosed |