Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 15/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.47 |
| ▸ | BACE2 | Q9Y5Z0 | 6/20 | 0.38 |
| ▸ | CTSD | P07339 | 3/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | CTSE | P14091 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | HTR1D | P28221 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | HTR5A | P47898 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL931802 | 0.89 | BACE1 (0.38) | BACE1KCNH2BACE2CTSDHTR1A | |
| SCHEMBL946218 | 0.88 | BACE1 (0.49) | BACE1KCNH2BACE2CTSDAPP | |
| SCHEMBL932745 | 0.85 | BACE1 (0.37) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL932626 | 0.84 | BACE1 (0.65) | BACE1KCNH2BACE2CTSDAPP | |
| SCHEMBL931210 | 0.81 | BACE1 (0.47) | BACE1KCNH2BACE2CTSDAPP | |
| SCHEMBL931281 | 0.80 | BACE1 (0.60) | BACE1KCNH2BACE2CTSDAPP | |
| SCHEMBL932230 | 0.77 | BACE1 (0.59) | BACE1KCNH2BACE2APP | |
| SCHEMBL931852 | 0.70 | BACE1 (0.49) | BACE1KCNH2BACE2CTSD | |
| SCHEMBL946784 | 0.70 | BACE1 (0.76) | BACE1KCNH2BACE2 | |
| SCHEMBL946602 | 0.69 | BACE1 (0.57) | BACE1KCNH2BACE2APPMEN1 |
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 2 patents. 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 |
| 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 |