Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4632635 | 0.77 | DDB1 (0.44) | — | |
| SCHEMBL2581431 | 0.76 | MAOB (0.40) | ALDH1A1SMN1; SMN2KMT2ARAB9A | |
| SCHEMBL2587085 | 0.69 | KMT2A (0.39) | KMT2A | |
| SCHEMBL515046 | 0.65 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2NPSR1HSD11B1ALOX15 | |
| SCHEMBL611198 | 0.62 | QRFPR (0.37) | ALDH1A1SMN1; SMN2ALOX15KMT2ARAB9A | |
| SCHEMBL515045 | 0.62 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2NPSR1HSD11B1ALOX15 | |
| SCHEMBL18896291 | 0.62 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2NPSR1HSD11B1ALOX15 | |
| SCHEMBL2579025 | 0.61 | MAOA (0.38) | ALDH1A1HSD11B1 | |
| SCHEMBL14394526 | 0.60 | KMT2A (0.45) | ALDH1A1SMN1; SMN2ALOX15HSD17B10KMT2A | |
| Acetonitrile SCHEMBL27498741 | 0.60 | TRPA1 (0.59) | — |
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-1924561-A2 | 6-ARYLALKYLAMINO- 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS | Eli Lilly & Company (US) | 2008-05-28 | — | — | EP | disclosed |
| WO-2007028083-A2 | 6-ARYLALKYLAMINO- 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS | ELI LILLY AND COMPANY (US) | 2007-03-08 | — | — | WO | disclosed |