Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1157247 | 0.85 | GAA (0.48) | P2RX7ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL12637595 | 0.84 | P2RX7 (0.43) | P2RX7ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL6546728 | 0.80 | SIGMAR1 (0.48) | CYP2D6SLC6A2 | |
| SCHEMBL13732891 | 0.77 | P2RX7 (0.41) | P2RX7ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL32673069 | 0.74 | ADRA2A (0.38) | P2RX7ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL32673000 | 0.74 | ADRA2A (0.38) | P2RX7ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL12894954 | 0.73 | SLC6A2 (0.57) | CYP1A2CYP2D6SLC6A2FDPSCHRNB2 | |
| SCHEMBL290633 | 0.73 | SLC6A2 (0.57) | CYP1A2CYP2D6SLC6A2FDPSCHRNB2 | |
| SCHEMBL29669201 | 0.73 | SLC6A2 (0.57) | CYP1A2CYP2D6SLC6A2FDPSCHRNB2 | |
| SCHEMBL31570740 | 0.73 | GAA (0.55) | KCNH2CYP1A2CYP3A4CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-8809379-B2 | Selective subtype alpha 2 adrenergic agents and methods for use thereof | ALLERGAN, INC. (US) | 2014-08-19 | — | — | US | disclosed |