Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 11/20 | 0.62 |
| ▸ | ADRB2 | P07550 | 7/20 | 0.62 |
| ▸ | ADRB1 | P08588 | 6/20 | 0.62 |
| ▸ | GLA | P06280 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.53 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.53 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 2/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 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 | |
|---|---|---|---|---|
| SCHEMBL11251142 | 0.89 | ADRB3 (0.77) | ADRB3ADRB2ADRB1GLAADRA1A | |
| SCHEMBL11247530 | 0.89 | ADRB3 (0.77) | ADRB3ADRB2ADRB1GLAADRA1A | |
| SCHEMBL10562541 | 0.84 | BCHE (0.69) | ADRB3ADRB2ADRB1ALDH1A1MEN1 | |
| SCHEMBL10562535 | 0.84 | BCHE (0.69) | ADRB3ADRB2ADRB1ALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL11477403 | 0.83 | BCHE (0.67) | ADRB3ADRB2ADRB1ALDH1A1MEN1 | |
| SCHEMBL10562146 | 0.83 | ADRB2 (0.57) | ADRB3ADRB2ADRB1ALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL10564630 | 0.83 | BCHE (0.67) | ADRB3ADRB2ADRB1ALDH1A1MEN1 | |
| SCHEMBL10562158 | 0.83 | ADRB2 (0.57) | ADRB3ADRB2ADRB1ALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL11477401 | 0.83 | BCHE (0.67) | ADRB3ADRB2ADRB1ALDH1A1MEN1 | |
| Ractopamine SCHEMBL352564 | 0.83 | ADRB2 (0.68) | ADRB3ADRB2ADRB1ALDH1A1MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4338333-A | ANTIOBESITY, HYPOGLYCEMIC | BEECHAM GROUP LIMITED (GB) | 1982-07-06 | — | — | US | claimed |
| US-4338333-A | ANTIOBESITY, HYPOGLYCEMIC | BEECHAM GROUP LIMITED (GB) | 1982-07-06 | — | — | US | disclosed |
| EP-0023385-A1 | Ethanamine derivatives, their preparation and use in pharmaceutical compositions | BEECHAM GROUP PLC (GB) | 1981-02-04 | — | — | EP | disclosed |