Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 9/20 | 0.62 |
| ▸ | BACE1 | P56817 | 8/20 | 0.61 |
| ▸ | ACHE | P22303 | 7/20 | 0.61 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7807284 | 0.91 | BCHE (0.73) | BCHEBACE1ACHE | |
| SCHEMBL3708632 | 0.87 | BCHE (0.61) | BCHEBACE1ACHECYP1A2CYP3A4 | |
| SCHEMBL28511753 | 0.85 | BCHE (0.83) | BCHEBACE1ACHECYP1A2CYP3A4 | |
| SCHEMBL28496734 | 0.85 | BCHE (0.83) | BCHEBACE1ACHECYP1A2CYP3A4 | |
| SCHEMBL13766270 | 0.84 | BCHE (0.62) | BCHEBACE1ACHECYP1A2CYP3A4 | |
| SCHEMBL7514730 | 0.84 | BCHE (0.62) | BCHEBACE1ACHECYP1A2CYP3A4 | |
| SCHEMBL8107565 | 0.84 | BCHE (0.58) | BCHEBACE1ACHECYP1A2CYP3A4 | |
| SCHEMBL8107571 | 0.84 | BCHE (0.58) | BCHEBACE1ACHECYP1A2CYP3A4 | |
| SCHEMBL11577003 | 0.83 | BCHE (0.69) | BCHEBACE1ACHESIGMAR1 | |
| SCHEMBL31015505 | 0.83 | BCHE (0.61) | BCHEBACE1ACHECYP1A2CYP3A4 |
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-2004002483-A1 | SUBSTITUTED 3- AND 4- AMINOMETHYLPIPERIDINES FOR USE AS BETA-SECRETASE IN THE TREATMENT OF ALZHEIMER’S DISEASE | ACTELION PHARMACEUTICALS LTD (CH) | 2004-01-08 | — | — | WO | disclosed |