Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.46 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | FNTA | P49354 | 1/20 | 0.43 |
| ▸ | FNTB | P49356 | 1/20 | 0.43 |
| ▸ | LIG1 | P18858 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1004028 | 0.87 | TSHR (0.58) | TSHRKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL19439093 | 0.86 | TSHR (0.53) | KEAP1TSHRKDM4EALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL15690391 | 0.85 | TSHR (0.56) | TSHRKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL30100451 | 0.84 | TSHR (0.51) | TSHRKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL3461077 | 0.84 | TSHR (0.51) | TSHRKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL1500536 | 0.84 | TSHR (0.51) | TSHRKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL5723969 | 0.84 | CYP19A1 (0.50) | TSHRKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL2292722 | 0.84 | TSHR (0.74) | KEAP1TSHRALDH1A1CA2CA1 | |
| Hydrochloric Acid SCHEMBL29693052 | 0.83 | TSHR (0.50) | TSHRKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL7134588 | 0.82 | TSHR (0.54) | KEAP1TSHRKDM4EALDH1A1MAPT |
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 |