Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.48 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | TOP2A | P11388 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 3/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30303108 | 0.94 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C8CYP2C9CYP2B6 | |
| SCHEMBL4684155 | 0.88 | ALDH1A1 (0.50) | CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL5723843 | 0.85 | ALOX5 (0.66) | CYP1A2CYP3A4CYP2C8CYP2C9CYP2B6 | |
| SCHEMBL20399514 | 0.83 | ALDH1A1 (0.51) | CYP1A2CYP3A4CYP2C8CYP2C9CYP2B6 | |
| SCHEMBL29610155 | 0.82 | ALOX5 (0.54) | CYP1A2CYP3A4CYP2C8CYP2C9CYP2B6 | |
| SCHEMBL12799076 | 0.82 | ALOX5 (0.54) | CYP1A2CYP3A4CYP2C8CYP2C9CYP2B6 | |
| SCHEMBL6583668 | 0.82 | ALOX5 (0.54) | CYP1A2CYP3A4CYP2C8CYP2C9CYP2B6 | |
| SCHEMBL8890692 | 0.82 | ALOX5 (0.49) | CYP1A2CYP3A4CYP2C8CYP2C9CYP2B6 | |
| SCHEMBL20399450 | 0.81 | KAT8 (0.53) | CYP1A2CYP3A4CYP2C8CYP2C9CYP2B6 | |
| SCHEMBL12788915 | 0.81 | TSHR (0.69) | CYP1A2CYP3A4ALDH1A1MTNR1AMTNR1B |
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-1633715-A1 | 2-(6-AMINO-PYRIDIN-3-YL)-2-HYDROXYETHYLAMINE DERIVATIVES AS BETA 2-ADRENOCEPTORS AGONISTS | Pfizer Limited (GB) | 2006-03-15 | — | — | EP | disclosed |
| WO-2004108676-A1 | 2-(6-AMINO-PYRIDIN-3-YL)-2-HYDROXYETHYLAMINE DERIVATIVES AS BETA 2-ADRENOCEPTORS AGONISTS | PFIZER LIMITED (GB) | 2004-12-16 | — | — | WO | disclosed |