Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 5/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.31 |
| ▸ | RORC | P51449 | 2/20 | 0.30 |
| ▸ | SYK | P43405 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8515572 | 0.71 | BACE1 (0.40) | BACE1AKR1B1CTSDAAK1RORC | |
| SCHEMBL9932816 | 0.71 | BACE1 (0.40) | BACE1AKR1B1CTSDAAK1 | |
| SCHEMBL876606 | 0.67 | AKR1B1 (0.43) | BACE1AKR1B1CTSD | |
| SCHEMBL877188 | 0.64 | AKR1B1 (0.46) | BACE1AKR1B1CTSD | |
| SCHEMBL9932213 | 0.63 | BACE1 (0.38) | BACE1CTSDAAK1RORC | |
| SCHEMBL877606 | 0.63 | BACE1 (0.45) | BACE1AKR1B1CTSD | |
| SCHEMBL8513209 | 0.62 | BACE1 (0.35) | BACE1AKR1B1CTSDAAK1 | |
| SCHEMBL8613061 | 0.60 | AKR1B1 (0.42) | BACE1AKR1B1CTSD | |
| SCHEMBL8613068 | 0.60 | AKR1B1 (0.42) | BACE1AKR1B1CTSD | |
| SCHEMBL4146006 | 0.60 | AAK1 (0.41) | BACE1CTSDAAK1USP30 |
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-2012071458-A1 | HETEROCYCLIC INHIBITORS OF BETA - SECRETASE FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | ARRAY BIOPHARMA INC. (US) | 2012-05-31 | — | — | WO | disclosed |