Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 4/20 | 0.54 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.54 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | DRD1 | P21728 | 1/20 | 0.51 |
| ▸ | DRD5 | P21918 | 1/20 | 0.51 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL9870176 | 0.90 | CHRM2 (0.67) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL10515136 | 0.88 | CHRM2 (0.50) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL9871211 | 0.86 | CHRM2 (0.59) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL9870471 | 0.84 | CHRM2 (0.50) | CHRM2CHRM4CHRM1 | |
| SCHEMBL10391184 | 0.83 | CYP1A2 (0.78) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL10391189 | 0.83 | CYP1A2 (0.78) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL10514973 | 0.82 | CYP1A2 (0.55) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL9870122 | 0.82 | CHRM2 (0.47) | CHRM2CHRM4CHRM1CYP1A2CYP3A4 | |
| SCHEMBL8879790 | 0.81 | CHRM2 (0.61) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL8880331 | 0.81 | CYP1A2 (0.81) | CHRM2CHRM4CHRM1CHRM3CYP1A2 |
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-0346745-A1 | Condensed diazepinones, processes for their preparation and pharmaceutical preparations containing them | Dr. Karl Thomae GmbH (DE) | 1989-12-20 | — | — | EP | claimed |
| US-5002943-A | Antispasmodic Agents, Bradycardia Treatment | MIHM GERHARD (DE) | 1991-03-26 | — | — | US | disclosed |
| EP-0346745-A1 | Condensed diazepinones, processes for their preparation and pharmaceutical preparations containing them | Dr. Karl Thomae GmbH (DE) | 1989-12-20 | — | — | EP | disclosed |