Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 17/20 | 0.77 |
| ▸ | ADRB1 | P08588 | 6/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.58 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.52 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4386830 | 1.00 | ADRB2 (0.77) | ADRB2ADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL4386838 | 1.00 | ADRB2 (0.77) | ADRB2ADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL13589418 | 0.92 | ADRB2 (0.73) | ADRB2ADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL5968913 | 0.90 | ADRB2 (0.70) | ADRB2ADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL5968910 | 0.90 | ADRB2 (0.70) | ADRB2ADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL4385649 | 0.90 | ADRB2 (0.70) | ADRB2ADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL4392993 | 0.90 | ADRB2 (0.70) | ADRB2ADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL4385639 | 0.90 | ADRB2 (0.70) | ADRB2ADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL4385163 | 0.89 | ADRB2 (0.76) | ADRB2ADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL4385168 | 0.89 | ADRB2 (0.76) | ADRB2ADRB1CYP1A2CYP2D6TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1942432-A | Phenylethanolamine derivatives as beta-2 agonists | PFIZER LTD (US) | 2007-04-04 | — | — | CN | disclosed |