Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.72 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.72 |
| ▸ | TSHR | P16473 | 1/20 | 0.72 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.72 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.56 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.56 |
| ▸ | RAD52 | P43351 | 1/20 | 0.53 |
| ▸ | C3AR1 | Q16581 | 1/20 | 0.46 |
| ▸ | CCR2 | P41597 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL194768 | 0.84 | TP53 (1.00) | TP53CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL4876834 | 0.82 | TP53 (0.98) | TP53CYP1A2CYP3A4CYP2D6TSHR | |
| Cetiedil SCHEMBL458084 | 0.78 | CYP3A4 (0.44) | TP53CYP1A2CYP3A4CYP2D6TSHR | |
| Cetiedil SCHEMBL14169136 | 0.78 | CYP3A4 (0.44) | TP53CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL4877646 | 0.75 | TP53 (0.84) | TP53CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL8975688 | 0.74 | TP53 (0.66) | TP53CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL12181203 | 0.73 | MAPT (0.55) | CYP1A2CYP2D6TSHRKMT2AL3MBTL1 | |
| SCHEMBL11147057 | 0.72 | C3AR1 (0.44) | CYP1A2CYP3A4CYP2D6TSHRADRA1A | |
| Cetiedil SCHEMBL121380 | 0.72 | CYP3A4 (0.40) | TP53CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL7601155 | 0.71 | TP53 (0.70) | TP53CYP1A2CYP3A4CYP2D6TSHR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0475844-B1 | Use of N-(1.hexahydroazepinylalkyl) acetamides for the manufacture of medicaments for the treatment of disorders of the cholineogic transmission | UNIV CAEN (FR) | 1996-04-17 | — | — | EP | claimed |
| US-5200405-A | USE OF N-(1-HEXAHYDROAZEPINYLALKYL) ACETAMIDES FOR THE TREATMENT OF CHOLINERGIC TRANSMISSION DISORDERS | ADIR ET COMPAGNIE (FR) | 1993-04-06 | — | — | US | claimed |
| JP-4257521-A | — | — | None | — | — | JP | disclosed |
| US-5200405-A | USE OF N-(1-HEXAHYDROAZEPINYLALKYL) ACETAMIDES FOR THE TREATMENT OF CHOLINERGIC TRANSMISSION DISORDERS | ADIR ET COMPAGNIE (FR) | 1993-04-06 | — | — | US | disclosed |
| JP-H04257521-A | N-(1-HEXAHYDROAZEPINYLALKYL)ACETAMIDE COMPOUND-CONTAINING PHARMACEUTICAL COMPOSITION FOR CHOLINERGIC TRANSMISSION DISORDER TREATMENT | ADIR | 1992-09-11 | — | — | JP | disclosed |