Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 11/20 | 0.61 |
| ▸ | ADRB3 | P13945 | 10/20 | 0.61 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.61 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9054230 | 0.90 | ADRB3 (0.70) | ADRB2ADRB3ADRB1 | |
| SCHEMBL8758015 | 0.86 | ADRB2 (0.59) | ADRB2ADRB3ADRB1 | |
| SCHEMBL8758572 | 0.85 | ADRB3 (0.58) | ADRB2ADRB3ADRB1PTGS1SLC6A2 | |
| SCHEMBL8758018 | 0.85 | ADRB3 (0.58) | ADRB2ADRB3ADRB1 | |
| SCHEMBL8757998 | 0.85 | ADRB3 (0.58) | ADRB2ADRB3ADRB1 | |
| SCHEMBL8758010 | 0.85 | ADRB3 (0.58) | ADRB2ADRB3ADRB1 | |
| SCHEMBL9055982 | 0.85 | ADRB3 (0.58) | ADRB2ADRB3ADRB1PTGS1SLC6A2 | |
| SCHEMBL9056005 | 0.85 | ADRB3 (0.58) | ADRB2ADRB3ADRB1PTGS1SLC6A2 | |
| SCHEMBL8758105 | 0.84 | ADRB3 (0.57) | ADRB2ADRB3ADRB1 | |
| SCHEMBL8758071 | 0.82 | ADRB3 (0.54) | ADRB2ADRB3ADRB1 |
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-1996004234-A1 | ARYLOXY ANDARYCTHIO PROPANOLAMINE DERIVATIVES USEFUL AS B3-ADRENORECEPTOR AGONISTS AND ANTAGONS OF THE B1 AND B2 ADRENORECEPTORS AND PHARMACEUTICAL COMPOSITION THEREOF | SMITHKLINE BEECHAM PLC (GB) | 1996-02-15 | — | — | WO | disclosed |