Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.51 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.51 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.49 |
| ▸ | DHFR | P00374 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL22259900 | 0.95 | CYP2D6 (0.56) | CYP2D6POLBCACNA2D1CACNA1BCACNB1 | |
| SCHEMBL20833013 | 0.95 | CYP2D6 (0.56) | CYP2D6POLBCACNA2D1CACNA1BCACNB1 | |
| SCHEMBL8507267 | 0.95 | CYP2D6 (0.56) | CYP2D6POLBCACNA2D1CACNA1BCACNB1 | |
| SCHEMBL20832991 | 0.95 | CYP2D6 (0.56) | CYP2D6POLBCACNA2D1CACNA1BCACNB1 | |
| SCHEMBL465920 | 0.89 | CYP2D6 (0.58) | CYP2D6POLBCACNA2D1CACNA1BCACNB1 | |
| SCHEMBL8493732 | 0.85 | POLB (0.59) | CYP2D6POLBCACNA2D1CACNA1BCACNB1 | |
| SCHEMBL5949168 | 0.84 | CYP2D6 (0.56) | CYP2D6POLBCACNA2D1CACNA1BCACNB1 | |
| SCHEMBL6560565 | 0.84 | CYP2D6 (0.56) | CYP2D6POLBCACNA2D1CACNA1BCACNB1 | |
| SCHEMBL6560568 | 0.84 | CYP2D6 (0.56) | CYP2D6POLBCACNA2D1CACNA1BCACNB1 | |
| SCHEMBL465909 | 0.84 | CYP2D6 (0.53) | CYP2D6POLBSLC6A3SLC6A2SLC6A4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4780478-A | Aminopropoxy-chromones useful as antidepressants | MERCK PATENT GESELLSCHAFT MIT BERSCHRANKTER HAFTUNG (DE) | 1988-10-25 | — | — | US | disclosed |
| US-4508732-A | Basic ethers useful as antidepressant agents | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1985-04-02 | — | — | US | disclosed |
| EP-0031885-B1 | BASIC ETHERS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR THEIR PREPARATION | MERCK PATENT GmbH (DE) | 1984-06-27 | — | — | EP | disclosed |
| US-4376123-A | Hexahydroazepinyloxy-chromones useful as antidepressants | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1983-03-08 | — | — | US | disclosed |
| EP-0031885-A1 | Basic ethers, pharmaceutical compositions containing them and process for their preparation | MERCK PATENT GmbH (DE) | 1981-07-15 | — | — | EP | disclosed |
| US-4225608-A | ANTIDEPRESSANTS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1980-09-30 | — | — | US | disclosed |