Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 17/20 | 0.37 |
| ▸ | BACE2 | Q9Y5Z0 | 16/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL990539 | 1.00 | BACE1 (0.37) | BACE1BACE2ALDH1A1GAATHRB | |
| SCHEMBL8515680 | 0.87 | BACE1 (0.34) | BACE1BACE2AKR1B1 | |
| SCHEMBL8515678 | 0.87 | BACE1 (0.34) | BACE1BACE2AKR1B1 | |
| SCHEMBL991283 | 0.87 | BACE1 (0.42) | BACE1BACE2 | |
| SCHEMBL991904 | 0.86 | BACE1 (0.37) | BACE1BACE2 | |
| SCHEMBL990489 | 0.82 | ALDH1A1 (0.33) | BACE1BACE2ALDH1A1GAATHRB | |
| SCHEMBL990487 | 0.82 | ALDH1A1 (0.33) | BACE1BACE2ALDH1A1GAATHRB | |
| SCHEMBL8516412 | 0.82 | MAPT (0.40) | BACE1BACE2ALDH1A1L3MBTL1 | |
| SCHEMBL8516408 | 0.82 | MAPT (0.40) | BACE1BACE2ALDH1A1L3MBTL1 | |
| SCHEMBL991259 | 0.81 | BACE1 (0.52) | BACE1BACE2 |
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-2011009897-A1 | FUSED AMINODIHYDROPYRIMIDONE DERIVATIVES | EISAI R&D MANAGEMENT CO., LTD (JP) | 2011-01-27 | — | — | WO | disclosed |