Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 16/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GALR3 | O60755 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 12/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 9/20 | 0.42 |
| ▸ | DRD1 | P21728 | 2/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | MLNR | O43193 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | MC3R | P41968 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11372453 | 0.91 | ADRB2 (0.46) | ADRB2ADRB1ADRB3DRD1ADRA1A | |
| Hydrochloric Acid SCHEMBL11365766 | 0.90 | ADRB2 (0.46) | ADRB2ADRB1ADRB3DRD1ADRA1A | |
| SCHEMBL11376096 | 0.90 | ADRB2 (0.46) | ADRB2ADRB1ADRB3DRD1ADRA1A | |
| SCHEMBL11373293 | 0.90 | ADRB2 (0.46) | ADRB2ADRB1ADRB3DRD1ADRA1A | |
| Hydrochloric Acid SCHEMBL11374289 | 0.89 | ADRB2 (0.45) | ADRB2ADRB1ADRB3DRD1ADRA1A | |
| SCHEMBL11375196 | 0.88 | ADRB2 (0.49) | ADRB2ADRB1ADRB3DRD1ADRA1A | |
| SCHEMBL11365956 | 0.86 | ADRB2 (0.44) | ADRB2ADRB1ADRB3DRD1ADRA1A | |
| SCHEMBL11383753 | 0.85 | ADRB2 (0.43) | ADRB2ADRB1ADRB3DRD1ADRA1A | |
| SCHEMBL11377591 | 0.85 | ADRB2 (0.45) | ADRB2ADRB1ADRB3ADRA1ASLC6A3 | |
| SCHEMBL11371511 | 0.84 | ADRB3 (0.43) | ADRB2ADRB1ADRB3DRD1ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |