Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 4/20 | 0.40 |
| ▸ | PPARA | Q07869 | 4/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 2/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28716660 | 0.91 | ALDH1A1 (0.43) | ALDH1A1RECQLPPARGPPARASLC6A4 | |
| SCHEMBL28716659 | 0.91 | ALDH1A1 (0.43) | ALDH1A1RECQLPPARGPPARASLC6A4 | |
| SCHEMBL544771 | 0.88 | ALDH1A1 (0.41) | ALDH1A1RECQLPPARGPPARASLC6A4 | |
| SCHEMBL5704277 | 0.86 | CSNK1E (0.42) | ALDH1A1SLC6A4LTA4HLMNASMN1; SMN2 | |
| SCHEMBL11874218 | 0.86 | CSNK1E (0.42) | ALDH1A1SLC6A4LTA4HLMNASMN1; SMN2 | |
| SCHEMBL2108376 | 0.83 | CYP2C19 (0.39) | ALDH1A1RECQLPPARGPPARASLC6A4 | |
| SCHEMBL6438883 | 0.82 | ALDH1A1 (0.46) | ALDH1A1RECQLPPARGPPARASLC6A4 | |
| SCHEMBL1847856 | 0.81 | ALDH1A1 (0.44) | ALDH1A1RECQLPPARGPPARASLC6A4 | |
| Ethylene Glycol SCHEMBL4376619 | 0.80 | LTA4H (0.40) | ALDH1A1PPARGPPARASLC6A4LTA4H | |
| SCHEMBL2569853 | 0.80 | ALDH1A1 (0.45) | ALDH1A1RECQLPPARGPPARASLC6A4 |
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-1720836-A1 | 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO [D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS | ELI LILLY AND COMPANY (US) | 2006-11-15 | — | — | EP | disclosed |
| WO-2005082859-A1 | 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS | ELI LILLY AND COMPANY (US) | 2005-09-09 | — | — | WO | disclosed |