Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 14/20 | 0.58 |
| ▸ | ADRB2 | P07550 | 11/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 8/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | SLC2A1 | P11166 | 4/20 | 0.52 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6554059 | 0.99 | ADRB3 (0.57) | ADRB3ADRB2ADRB1CYP2D6CYP3A4 | |
| SCHEMBL6553076 | 0.92 | ADRB3 (0.57) | ADRB3ADRB2ADRB1CYP2D6CYP3A4 | |
| Hydrochloric Acid SCHEMBL6554057 | 0.91 | ADRB3 (0.56) | ADRB3ADRB2ADRB1CYP2D6CYP3A4 | |
| SCHEMBL6553131 | 0.90 | ADRB3 (0.68) | ADRB3ADRB2ADRB1CYP2D6CYP3A4 | |
| SCHEMBL6541194 | 0.90 | ADRB3 (0.58) | ADRB3ADRB2ADRB1CYP2D6CYP3A4 | |
| SCHEMBL6541204 | 0.90 | ADRB3 (0.58) | ADRB3ADRB2ADRB1CYP2D6CYP3A4 | |
| SCHEMBL6540533 | 0.86 | ADRB3 (0.69) | ADRB3ADRB2ADRB1CYP2D6CYP3A4 | |
| SCHEMBL6540539 | 0.86 | ADRB3 (0.69) | ADRB3ADRB2ADRB1CYP2D6CYP3A4 | |
| Hydrochloric Acid SCHEMBL6540803 | 0.85 | ADRB3 (0.68) | ADRB3ADRB2ADRB1CYP2D6CYP3A4 | |
| Hydrochloric Acid SCHEMBL6540807 | 0.85 | ADRB3 (0.68) | ADRB3ADRB2ADRB1CYP2D6CYP3A4 |
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-1389185-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-02-18 | — | — | EP | disclosed |
| WO-2002094770-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-11-28 | — | — | WO | disclosed |