Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 11/20 | 0.54 |
| ▸ | CASP3 | P42574 | 1/20 | 0.54 |
| ▸ | CASP6 | P55212 | 1/20 | 0.54 |
| ▸ | ADRB1 | P08588 | 14/20 | 0.51 |
| ▸ | ADRB3 | P13945 | 12/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
| ▸ | DRD3 | P35462 | 2/20 | 0.48 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2853303 | 1.00 | ADRB2 (0.54) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL2853304 | 1.00 | ADRB2 (0.54) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL2823748 | 0.93 | ADRB2 (0.58) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| Formic Acid SCHEMBL2792053 | 0.90 | ADRB2 (0.56) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL2828124 | 0.87 | ADRB2 (0.54) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL13232142 | 0.87 | ADRB2 (0.54) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL2828122 | 0.87 | ADRB2 (0.54) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL13232144 | 0.85 | ADRB2 (0.69) | ADRB2ADRB1ADRB3CYP2D6ADRA1A | |
| SCHEMBL2823746 | 0.85 | ADRB2 (0.69) | ADRB2ADRB1ADRB3CYP2D6ADRA1A | |
| SCHEMBL2823742 | 0.85 | ADRB2 (0.69) | ADRB2ADRB1ADRB3CYP2D6ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2057122-B1 | DERIVATIVES OF 4-(2-AMINO-1-HYDROXYETHYL)PHENOL AS AGONISTS OF THE 2 ADRENERGIC RECEPTOR | ALMIRALL SA (ES) | 2010-09-01 | — | — | EP | claimed |