Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 12/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 9/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 8/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6244067 | 0.87 | ADRB3 (0.44) | ADRB3ADRB2ADRB1CYP2D6CYP3A4 | |
| SCHEMBL6676611 | 0.79 | CYP1A2 (0.42) | ADRB3ADRB2ADRB1CYP2D6CYP1A2 | |
| SCHEMBL6676608 | 0.79 | CYP1A2 (0.42) | ADRB3ADRB2ADRB1CYP2D6CYP1A2 | |
| SCHEMBL6266343 | 0.75 | ADRB3 (0.45) | ADRB3ADRB2ADRB1CYP2D6ADRA1D | |
| SCHEMBL6540794 | 0.72 | ADRB3 (0.63) | ADRB3ADRB1 | |
| SCHEMBL6540789 | 0.72 | ADRB3 (0.63) | ADRB3ADRB1 | |
| Hydrochloric Acid SCHEMBL6540635 | 0.71 | ADRB3 (0.62) | ADRB3ADRB1 | |
| Hydrochloric Acid SCHEMBL6540628 | 0.71 | ADRB3 (0.62) | ADRB3ADRB1 | |
| SCHEMBL6540353 | 0.71 | TAS2R14 (0.42) | ADRB3ADRB2ADRB1 | |
| SCHEMBL6540351 | 0.71 | TAS2R14 (0.42) | ADRB3ADRB2ADRB1 |
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-2004045610-A1 | AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA-3 ADRENERGIC RECEPTOR AGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD (JP) | 2004-06-03 | — | — | WO | disclosed |