Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 13/20 | 0.68 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.60 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL932236 | 0.85 | BACE1 (0.53) | BACE1KCNH2BACE2 | |
| SCHEMBL931716 | 0.68 | BACE1 (0.78) | BACE1KCNH2BACE2 | |
| SCHEMBL932165 | 0.65 | BACE1 (0.79) | BACE1KCNH2BACE2 | |
| SCHEMBL931601 | 0.65 | BACE1 (0.50) | BACE1KCNH2BACE2 | |
| SCHEMBL6892665 | 0.65 | BACE1 (0.80) | BACE1KCNH2BACE2 | |
| SCHEMBL22026014 | 0.61 | BACE1 (0.55) | BACE1BACE2 | |
| SCHEMBL932399 | 0.60 | BACE1 (0.53) | BACE1KCNH2BACE2 | |
| SCHEMBL31681935 | 0.58 | IDO1 (0.47) | — | |
| SCHEMBL11886380 | 0.58 | IDO1 (0.47) | — | |
| SCHEMBL9685101 | 0.57 | RAB9A (0.47) | — |
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 | claimed |
| 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 |