Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 13/20 | 0.40 |
| ▸ | BACE2 | Q9Y5Z0 | 6/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CTSD | P07339 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4218556 | 1.00 | BACE1 (0.40) | BACE1BACE2CYP3A4LMNACTSD | |
| SCHEMBL3508857 | 0.94 | BACE1 (0.40) | BACE1BACE2CYP3A4LMNACTSD | |
| SCHEMBL3509802 | 0.93 | CCR1 (0.42) | BACE1BACE2CYP3A4LMNACTSD | |
| SCHEMBL3509367 | 0.93 | BACE1 (0.39) | BACE1BACE2CYP3A4LMNACTSD | |
| SCHEMBL3510514 | 0.93 | BACE1 (0.39) | BACE1BACE2CYP3A4CTSD | |
| SCHEMBL3511560 | 0.93 | BACE1 (0.39) | BACE1BACE2CYP3A4CTSDMEN1 | |
| SCHEMBL4218451 | 0.93 | BACE1 (0.40) | BACE1BACE2CYP3A4CTSD | |
| SCHEMBL4204589 | 0.93 | BACE1 (0.40) | BACE1BACE2CYP3A4CTSD | |
| SCHEMBL3510454 | 0.92 | BACE1 (0.41) | BACE1BACE2CYP3A4LMNACTSD | |
| SCHEMBL4208737 | 0.92 | BACE1 (0.41) | BACE1BACE2CYP3A4LMNACTSD |
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 |
|---|---|---|---|---|---|---|---|
| US-7504420-B2 | Compounds which inhibit beta-secretase activity and methods of use | COMENTIS, INC. (US) | 2009-03-17 | — | — | US | claimed |