Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 18/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 12/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 5/20 | 0.45 |
| ▸ | DRD2 | P14416 | 5/20 | 0.45 |
| ▸ | DRD3 | P35462 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9707082 | 0.81 | ADRB2 (0.52) | ADRB2ADRB1ADRA1DDRD2DRD3 | |
| SCHEMBL9520760 | 0.80 | ADRB2 (0.66) | ADRB2ADRB1ADRA1DDRD2DRD3 | |
| Hydrochloric Acid SCHEMBL8881126 | 0.79 | ADRB2 (0.65) | ADRB2ADRB1ADRA1DDRD2DRD3 | |
| SCHEMBL9522342 | 0.78 | ADRB2 (0.72) | ADRB2ADRB1ADRA1DDRD2DRD3 | |
| SCHEMBL7839170 | 0.76 | ADRB2 (0.46) | ADRB2ADRB1DRD2 | |
| SCHEMBL7838618 | 0.75 | ADRB2 (0.38) | ADRB2ADRB1DRD2DRD3 | |
| SCHEMBL7839902 | 0.75 | ADRB2 (0.55) | ADRB2ADRB1ADRA1DDRD2 | |
| Trifluoroacetic Acid SCHEMBL7839611 | 0.74 | ADRB2 (0.46) | ADRB2ADRB1DRD2 | |
| SCHEMBL9520825 | 0.73 | ADRB2 (0.55) | ADRB2ADRB1DRD2 | |
| SCHEMBL1803587 | 0.73 | ADRB2 (0.51) | ADRB2ADRB1DRD3 |
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-0558677-A1 | BIOLOGICALLY ACTIVE AMINES | Astra Pharmaceuticals Limited (GB) | 1993-09-08 | — | — | EP | claimed |
| WO-1992008708-A1 | BIOLOGICALLY ACTIVE AMINES | FISONS PLC (GB) | 1992-05-29 | — | — | WO | claimed |