Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.31 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.31 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5732466 | 0.79 | MTNR1A (0.47) | CYP1A2MTNR1AMTNR1B | |
| SCHEMBL5732501 | 0.75 | DRD2 (0.33) | — | |
| SCHEMBL5764333 | 0.73 | DRD2 (0.30) | — | |
| SCHEMBL5732147 | 0.72 | SCN3A (0.30) | — | |
| SCHEMBL5752287 | 0.70 | PNMT (0.42) | CYP1A2MTNR1AMTNR1B | |
| SCHEMBL507676 | 0.68 | ESR1 (0.52) | MTNR1B | |
| SCHEMBL3828896 | 0.68 | BRD4 (0.36) | — | |
| SCHEMBL3832960 | 0.68 | PNMT (0.46) | — | |
| SCHEMBL506348 | 0.67 | NMT1 (0.36) | — | |
| SCHEMBL5770327 | 0.63 | MEN1 (0.40) | NQO2HTR2A |
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 |