Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 8/20 | 0.40 |
| ▸ | CA2 | P00918 | 8/20 | 0.40 |
| ▸ | CA6 | P23280 | 3/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 4/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA5A | P35218 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | PTGES2 | Q9H7Z7 | 2/20 | 0.35 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | PDIA6 | Q15084 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10550048 | 0.88 | ADRB2 (0.46) | ADRB2ADRB1ADRB3CA1CA2 | |
| SCHEMBL10553004 | 0.88 | ADRB2 (0.46) | ADRB2ADRB1ADRB3CA1CA2 | |
| SCHEMBL21092385 | 0.84 | ADRB2 (0.50) | ADRB2ADRB1ADRB3CA1CA2 | |
| SCHEMBL8355995 | 0.81 | CA2 (0.48) | ADRB2ADRB1ADRB3CA1CA2 | |
| SCHEMBL10686977 | 0.79 | CA2 (0.52) | CA1CA2CA6CA4CA9 | |
| SCHEMBL1880967 | 0.77 | CA1 (0.49) | ADRB2ADRB1ADRB3CA1CA2 | |
| SCHEMBL1876554 | 0.76 | KCNA3 (0.50) | ADRB2ADRB1ADRB3CA1CA2 | |
| SCHEMBL9585312 | 0.75 | TAAR1 (0.44) | BCHEACHE | |
| SCHEMBL8349565 | 0.75 | CA2 (0.54) | CA1CA2CA6CA4CA9 | |
| SCHEMBL1805053 | 0.74 | CA2 (0.45) | ADRB2ADRB1ADRB3CA1CA2 |
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-1360174-A1 | PHENETHANOLAMINE DERIVATIVES FOR TREATMENT OF RESPIRATORY DISEASES | GLAXO GROUP LIMITED (GB) | 2003-11-12 | — | — | EP | disclosed |
| WO-2002066422-A1 | PHENETHANOLAMINE DERIVATIVES FOR TREATMENT OF RESPIRATORY DISEASES | GLAXO GROUP LIMITED (GB) | 2002-08-29 | — | — | WO | disclosed |