Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 13/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 10/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6266343 | 0.80 | ADRB3 (0.45) | ADRB3ADRB1CYP1A2CYP2D6ADRB2 | |
| SCHEMBL6244072 | 0.75 | CYP1A2 (0.43) | ADRB3ADRB1CYP1A2CYP2D6PKM | |
| SCHEMBL6676611 | 0.75 | CYP1A2 (0.42) | ADRB3ADRB1CYP1A2CYP2D6PKM | |
| SCHEMBL6676608 | 0.75 | CYP1A2 (0.42) | ADRB3ADRB1CYP1A2CYP2D6PKM | |
| SCHEMBL6266345 | 0.74 | ADRB3 (0.55) | ADRB3ADRB1 | |
| SCHEMBL28425782 | 0.73 | CYP1A2 (0.50) | ADRB3ADRB1CYP1A2CYP2D6PKM | |
| SCHEMBL6242576 | 0.73 | CYP1A2 (0.50) | ADRB3ADRB1CYP1A2CYP2D6PKM | |
| SCHEMBL30782003 | 0.73 | CYP1A2 (0.50) | ADRB3ADRB1CYP1A2CYP2D6PKM | |
| SCHEMBL6242570 | 0.73 | CYP1A2 (0.50) | ADRB3ADRB1CYP1A2CYP2D6PKM | |
| SCHEMBL6239352 | 0.70 | ADRB3 (0.42) | ADRB3ADRB1ADRB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1546086-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004002939-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-01-08 | — | — | WO | disclosed |