Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 5/20 | 0.67 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.65 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.65 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | DRD1 | P21728 | 1/20 | 0.61 |
| ▸ | DRD5 | P21918 | 1/20 | 0.61 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL9871211 | 0.94 | CHRM2 (0.59) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL8879790 | 0.90 | CHRM2 (0.61) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL9870103 | 0.90 | CHRM2 (0.54) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| Hydrochloric Acid SCHEMBL9870848 | 0.90 | CHRM2 (0.60) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL9871047 | 0.89 | CHRM2 (0.58) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL10459903 | 0.88 | CHRM2 (0.62) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL8879186 | 0.87 | CHRM2 (0.61) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL10519813 | 0.85 | CHRM2 (0.61) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL10510299 | 0.84 | CYP1A2 (0.85) | CHRM2CHRM4CHRM1CHRM3CYP1A2 | |
| SCHEMBL10515060 | 0.83 | CHRM2 (0.71) | 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 |
|---|---|---|---|---|---|---|---|
| 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 |
| EP-0173462-B1 | ELLIPTICINE DERIVATIVE AND PRODUCTION PROCESS THEREOF | SUNTORY LIMITED (JP) | 1989-10-25 | — | — | EP | disclosed |