Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.31 |
| ▸ | MT-CO1 | P00395 | 1/20 | 0.31 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2439182 | 0.83 | NPC1 (0.40) | EPHX1 | |
| SCHEMBL21368757 | 0.77 | NPC1 (0.41) | EPHX1 | |
| SCHEMBL6987430 | 0.77 | EPHX1 (0.37) | EPHX1 | |
| SCHEMBL1515769 | 0.77 | IDO1 (0.46) | EPHX1 | |
| SCHEMBL6192446 | 0.76 | EPHX1 (0.38) | EPHX1 | |
| SCHEMBL2442101 | 0.76 | RAB9A (0.44) | EPHX1 | |
| SCHEMBL6510867 | 0.76 | RAB9A (0.44) | EPHX1 | |
| SCHEMBL6985435 | 0.76 | EPHX1 (0.39) | EPHX1 | |
| SCHEMBL193457 | 0.75 | IDO1 (0.49) | EPHX1 | |
| SCHEMBL8386053 | 0.74 | NPC1 (0.38) | — |
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 |