Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 10/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 9/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11367767 | 0.90 | ADRB2 (0.44) | SLC6A4ADRA1AHTR1ASLC6A2ADRB2 | |
| SCHEMBL11373558 | 0.89 | ADRB2 (0.41) | SLC6A4ADRA1AHTR1ASLC6A2ADRB2 | |
| SCHEMBL11374973 | 0.88 | ADRB2 (0.40) | SLC6A4ADRA1AHTR1ASLC6A2ADRB2 | |
| SCHEMBL11365722 | 0.88 | ADRB2 (0.46) | SLC6A4ADRA1AHTR1ASLC6A2ADRB2 | |
| SCHEMBL11367795 | 0.87 | ADRB2 (0.39) | SLC6A4ADRA1AHTR1ASLC6A2ADRB2 | |
| SCHEMBL11371503 | 0.83 | SLC6A4 (0.48) | SLC6A4ADRA1AHTR1ASLC6A2ADRB2 | |
| SCHEMBL11368373 | 0.83 | SLC6A4 (0.50) | SLC6A4ADRA1AHTR1ASLC6A2ADRB2 | |
| SCHEMBL11574990 | 0.83 | ADRB2 (0.58) | SLC6A4ADRA1AHTR1ASLC6A2ADRB2 | |
| SCHEMBL11369119 | 0.82 | ADRB3 (0.44) | SLC6A4ADRA1AADRB2ADRB3ADRB1 | |
| SCHEMBL11366331 | 0.82 | ADRB2 (0.45) | SLC6A4ADRA1AHTR1ASLC6A2ADRB2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4304790-A | 2-(Alkylthio, alkylsulfinyl or alkylsulfonyl)-4-[2-anilinoalkylamino)-1-hydroxyethyl]phenols and derivatives thereof | SCHERING CORPORATION (US) | 1981-12-08 | — | — | US | claimed |
| US-4304790-A | 2-(Alkylthio, alkylsulfinyl or alkylsulfonyl)-4-[2-anilinoalkylamino)-1-hydroxyethyl]phenols and derivatives thereof | SCHERING CORPORATION (US) | 1981-12-08 | — | — | US | disclosed |