Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 13/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 10/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 11/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.38 |
| ▸ | CHRNG | P07510 | 1/20 | 0.38 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.38 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8586761 | 1.00 | ADRB3 (0.41) | ADRB3ADRB2ADRB1CYP2B6ADRA1D | |
| SCHEMBL7708901 | 0.90 | SLC6A2 (0.39) | ADRB3ADRB2ADRB1CYP2B6ADRA1D | |
| SCHEMBL7069969 | 0.80 | ADRB3 (0.35) | ADRB3ADRB2ADRB1CYP2B6ADRA1D | |
| SCHEMBL7714914 | 0.80 | ADRB3 (0.40) | ADRB3ADRB2ADRB1CYP2B6ADRA1D | |
| SCHEMBL7714916 | 0.80 | ADRB3 (0.40) | ADRB3ADRB2ADRB1CYP2B6ADRA1D | |
| SCHEMBL9063602 | 0.79 | AOC3 (0.43) | CYP2B6SLC6A2SLC6A4IDO1MEN1 | |
| SCHEMBL7708906 | 0.78 | ADRB3 (0.39) | ADRB3ADRB2ADRB1IDO1MEN1 | |
| SCHEMBL9274010 | 0.78 | ADRB2 (0.46) | ADRB3ADRB2ADRB1 | |
| SCHEMBL9274013 | 0.78 | ADRB2 (0.46) | ADRB3ADRB2ADRB1 | |
| SCHEMBL8310050 | 0.77 | MEN1 (0.41) | ADRB3ADRB2ADRB1CYP2B6CYP2C19 |
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-1998043953-A1 | NAPHTHALENESULPHONIC OR CARBOXYLIC ACIDS AND THEIR USE AS ATYPICAL BETA-ADRENOCEPTOR AGONISTS | GLAXO GROUP LIMITED (GB) | 1998-10-08 | — | — | WO | disclosed |