Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 6/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | PNMT | P11086 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | APP | P05067 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | METAP1 | P53582 | 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 | |
|---|---|---|---|---|
| SCHEMBL17675565 | 0.91 | BACE1 (0.42) | BACE1ADRA2APNMTADRA2BADRA2C | |
| SCHEMBL17675528 | 0.85 | BACE1 (0.42) | BACE1ADRA2APNMTADRA2BADRA2C | |
| SCHEMBL17675490 | 0.78 | BACE1 (0.45) | BACE1ADRA2APNMTADRA2BADRA2C | |
| SCHEMBL15748819 | 0.78 | BACE1 (0.45) | BACE1ADRA2APNMTADRA2BADRA2C | |
| SCHEMBL17088024 | 0.73 | BACE1 (0.45) | BACE1ADRA2APNMTADRA2BADRA2C | |
| SCHEMBL15357673 | 0.73 | BACE1 (0.45) | BACE1HTR2AHTR2CHTR2B | |
| SCHEMBL17675384 | 0.73 | BACE1 (0.45) | BACE1HTR2AHTR2CHTR2B | |
| SCHEMBL17675567 | 0.72 | BACE1 (0.43) | BACE1APP | |
| SCHEMBL17675644 | 0.71 | TDP2 (0.33) | BACE1ADRA2APNMTADRA2BADRA2C | |
| SCHEMBL19534477 | 0.70 | BACE1 (0.43) | BACE1 |
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-2016055858-A1 | COMPOUNDS AND THEIR USE AS BACE INHIBITORS | ASTRAZENECA AB (SE) | 2016-04-14 | — | — | WO | disclosed |