Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 14/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 11/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 11/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 3/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6677749 | 1.00 | ADRB3 (0.36) | ADRB3ADRB1ADRB2CYP2D6ADRA1D | |
| SCHEMBL6682388 | 0.85 | ADRB3 (0.38) | ADRB3ADRB1ADRB2CYP2D6ADRA1D | |
| SCHEMBL6695623 | 0.82 | ADRB3 (0.35) | ADRB3ADRB1ADRB2CYP2D6ADRA1D | |
| SCHEMBL6805816 | 0.82 | ADRB3 (0.55) | ADRB3ADRB1ADRB2CYP2D6ADRA1D | |
| SCHEMBL6805812 | 0.82 | ADRB3 (0.55) | ADRB3ADRB1ADRB2CYP2D6ADRA1D | |
| SCHEMBL6805813 | 0.82 | ADRB3 (0.55) | ADRB3ADRB1ADRB2CYP2D6ADRA1D | |
| Hydrochloric Acid SCHEMBL6679551 | 0.81 | SLC2A1 (0.55) | ADRB3ADRB1ADRB2CYP2D6ADRA1D | |
| Hydrochloric Acid SCHEMBL6810369 | 0.81 | SLC2A1 (0.55) | ADRB3ADRB1ADRB2CYP2D6ADRA1D | |
| Hydrochloric Acid SCHEMBL6676147 | 0.81 | SLC2A1 (0.55) | ADRB3ADRB1ADRB2CYP2D6ADRA1D | |
| Hydrochloric Acid SCHEMBL6676141 | 0.81 | SLC2A1 (0.55) | ADRB3ADRB1ADRB2CYP2D6ADRA1D |
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 |