Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 15/20 | 0.56 |
| ▸ | ADRB3 | P13945 | 7/20 | 0.51 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | CASP6 | P55212 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4261688 | 1.00 | ADRB2 (0.56) | ADRB2ADRB3ADRB1CYP2D6ADRA1D | |
| SCHEMBL4255083 | 0.93 | ADRB2 (0.54) | ADRB2ADRB3ADRB1CYP2D6CYP3A4 | |
| SCHEMBL4255084 | 0.89 | ADRB2 (0.57) | ADRB2ADRB3ADRB1CYP2D6ADRA1D | |
| SCHEMBL4261367 | 0.87 | ADRB2 (0.53) | ADRB2ADRB3ADRB1CYP2D6ADRA1D | |
| SCHEMBL4389552 | 0.86 | ADRB2 (0.54) | ADRB2ADRB3ADRB1CYP2D6ADRA1D | |
| SCHEMBL4389556 | 0.86 | ADRB2 (0.54) | ADRB2ADRB3ADRB1CYP2D6ADRA1D | |
| SCHEMBL10662416 | 0.85 | ADRB2 (0.52) | ADRB2ADRB3ADRB1CYP2D6ADRA1D | |
| SCHEMBL10662496 | 0.85 | ADRB2 (0.52) | ADRB2ADRB3ADRB1CYP2D6ADRA1D | |
| SCHEMBL4255273 | 0.85 | ADRB2 (0.72) | ADRB2ADRB3ADRB1CASP3CASP6 | |
| SCHEMBL4257427 | 0.85 | ADRB2 (0.72) | ADRB2ADRB3ADRB1CASP3CASP6 |
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-1624868-B9 | \"(2-HYDROXY-2-(4-HYDROXY-3-HYDOXYMETHYLPHENYL)-ETHYLAMINO)- PROPYL]PHENYL DERIVATIVES AS BETA2 AGONISTS | PFIZER LTD (GB) | 2009-08-12 | — | — | EP | claimed |
| EP-1624868-B1 | \"(2-HYDROXY-2-(4-HYDROXY-3-HYDOXYMETHYLPHENYL)-ETHYLAMINO)- PROPYL]PHENYL DERIVATIVES AS BETA2 AGONISTS | PFIZER LTD (GB) | 2008-11-12 | — | — | EP | claimed |