Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 3/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CTSE | P14091 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HRH2 | P25021 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL932692 | 0.85 | BACE1 (0.42) | BACE1SLC6A4CYP3A4CTSECYP2C19 | |
| SCHEMBL945139 | 0.85 | BACE1 (0.42) | BACE1SLC6A4CYP3A4CTSECYP2C19 | |
| SCHEMBL945955 | 0.85 | BACE1 (0.42) | BACE1SLC6A4CYP3A4CTSECYP2C19 | |
| SCHEMBL945249 | 0.60 | CHRNA1 (0.37) | BACE1SLC6A4SLC6A2SLC6A3ALDH1A1 | |
| SCHEMBL4093476 | 0.58 | MAOB (0.50) | SLC6A4CYP3A4SLC6A3ALDH1A1ALOX15 | |
| SCHEMBL931861 | 0.58 | BACE1 (0.53) | BACE1SLC6A4CYP3A4CTSECYP2C19 | |
| SCHEMBL932399 | 0.58 | BACE1 (0.53) | BACE1SLC6A4CYP3A4CTSECYP2C19 | |
| SCHEMBL931327 | 0.58 | BACE1 (0.53) | BACE1SLC6A4CYP3A4CTSECYP2C19 | |
| SCHEMBL6893051 | 0.58 | KDM2B (0.42) | CYP2C19ALDH1A1LMNAHPGD | |
| SCHEMBL8845648 | 0.57 | SLC6A4 (0.45) | BACE1SLC6A4CYP3A4CYP2C19SLC6A2 |
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-2011002408-A1 | NOVEL COMPOUNDS FOR TREATMENT OF NEURODEGENERATION ASSOCIATED WITH DISEASES, SUCH AS ALZHEIMER'S DISEASE OR DEMENTIA | ASTRAZENECA AB (SE) | 2011-01-06 | — | — | WO | disclosed |