Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.52 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.52 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9824476 | 0.92 | CHRM2 (0.59) | CHRM2CYP1A2CYP3A4CHRM4CHRM1 | |
| SCHEMBL9824348 | 0.84 | CHRM2 (0.67) | CHRM2CYP1A2CYP3A4CHRM4CHRM1 | |
| SCHEMBL9824078 | 0.80 | CHRM2 (0.61) | CHRM2CYP1A2CYP3A4CHRM4CHRM1 | |
| SCHEMBL9824001 | 0.79 | CHRM2 (0.63) | CHRM2CYP1A2CYP3A4CHRM4CHRM1 | |
| SCHEMBL9824966 | 0.78 | CHRM2 (0.43) | CHRM2CYP1A2CYP3A4CHRM4CHRM1 | |
| SCHEMBL9824970 | 0.77 | CHRM2 (0.59) | CHRM2CYP1A2CYP3A4CHRM4CHRM1 | |
| SCHEMBL9824015 | 0.77 | CHRM2 (0.83) | CHRM2CYP1A2CYP3A4CHRM4CHRM1 | |
| SCHEMBL9824376 | 0.77 | CYP1A2 (0.54) | CHRM2CYP1A2CYP3A4CHRM4CHRM1 | |
| SCHEMBL9824011 | 0.77 | CHRM2 (0.72) | CHRM2CYP1A2CYP3A4CHRM4CHRM1 | |
| SCHEMBL10568996 | 0.76 | CHRM2 (0.61) | CHRM2CYP1A2CYP3A4CHRM4CHRM1 |
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-0273239-B1 | CONDENSED DIAZEPINONES, PROCESSES FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | Dr. Karl Thomae GmbH (DE) | 1991-03-06 | — | — | EP | disclosed |
| US-4873236-A | BRADYCARDIAL AGENTS | DR. KARL THOMAE GMBH (DE) | 1989-10-10 | — | — | US | disclosed |