Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 10/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | BACE2 | Q9Y5Z0 | 4/20 | 0.38 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7924845 | 0.91 | CYP1A2 (0.42) | BACE1ADRA2ACYP1A2MAOASLC6A2 | |
| SCHEMBL7917963 | 0.89 | BACE1 (0.43) | BACE1ADRA2ATAAR1BACE2KCNH2 | |
| SCHEMBL7918038 | 0.84 | BACE1 (0.43) | BACE1ADRA2ATAAR1BACE2KCNH2 | |
| SCHEMBL7920091 | 0.84 | CYP1A2 (0.49) | BACE1ADRA2ACYP1A2MAOASLC6A2 | |
| SCHEMBL7919754 | 0.81 | TAAR1 (0.46) | BACE1ADRA2ATAAR1KCNH2 | |
| SCHEMBL7921968 | 0.79 | MEN1 (0.42) | BACE1BACE2KCNH2 | |
| SCHEMBL7913188 | 0.79 | BACE1 (0.39) | BACE1BACE2KCNH2 | |
| SCHEMBL7916183 | 0.75 | TAAR1 (0.52) | BACE1ADRA2ATAAR1 | |
| SCHEMBL7919559 | 0.75 | TAAR1 (0.52) | BACE1ADRA2ATAAR1 | |
| SCHEMBL7922745 | 0.75 | TAAR1 (0.52) | BACE1ADRA2ATAAR1 |
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-2010042475-A1 | SPIROAMINOOXAZOLINE ANALOGUES AS ALPHA2C ADRENERGIC RECEPTOR MODULATORS | SCHERING CORPORATION (US) | 2010-04-15 | — | — | WO | disclosed |