Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.58 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.58 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL9675382 | 0.98 | CHRM2 (0.58) | CYP1A2CYP3A4CHRM2CHRM4CHRM1 | |
| SCHEMBL9675992 | 0.95 | CYP1A2 (0.60) | CYP1A2CYP3A4CHRM2CHRM4CHRM1 | |
| SCHEMBL9674409 | 0.92 | CHRM2 (0.65) | CYP1A2CYP3A4CHRM2CHRM4CHRM1 | |
| SCHEMBL9675660 | 0.90 | CHRM2 (0.67) | CYP1A2CYP3A4CHRM2CHRM4CHRM1 | |
| SCHEMBL9676527 | 0.89 | CHRM2 (0.67) | CYP1A2CYP3A4CHRM2CHRM4CHRM1 | |
| SCHEMBL9728337 | 0.87 | CHRM2 (0.75) | CYP1A2CYP3A4CHRM2CHRM4CHRM1 | |
| SCHEMBL9675771 | 0.87 | CHRM2 (0.61) | CYP1A2CYP3A4CHRM2CHRM4CHRM1 | |
| SCHEMBL9674004 | 0.87 | — | — | |
| SCHEMBL10514622 | 0.85 | CHRM2 (0.74) | CYP1A2CYP3A4CHRM2CHRM4CHRM1 | |
| SCHEMBL9674210 | 0.84 | CHRM2 (0.62) | CYP1A2CYP3A4CHRM2CHRM4CHRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0306698-B1 | CONDENSED DIAZEPINONES, PROCESSES FOR THEIR PREPARATION, AND MEDICAMENTS CONTAINING THESE COMPOUNDS | Dr. Karl Thomae GmbH (DE) | 1992-03-25 | — | — | EP | disclosed |
| US-4931436-A | BRADYCARDIAL AGENTS | DR. KARL THOMAE GMBH (DE) | 1990-06-05 | — | — | US | disclosed |
| EP-0306698-A1 | Condensed diazepinones, processes for their preparation, and medicaments containing these compounds | Dr. Karl Thomae GmbH (DE) | 1989-03-15 | — | — | EP | disclosed |