Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 5/20 | 0.73 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.73 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.73 |
| ▸ | DRD1 | P21728 | 4/20 | 0.73 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.73 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.73 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.73 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.73 |
| ▸ | HTR2A | P28223 | 3/20 | 0.73 |
| ▸ | HRH1 | P35367 | 3/20 | 0.73 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.73 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.73 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.73 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.73 |
| ▸ | HTR2C | P28335 | 2/20 | 0.73 |
| ▸ | HTR2B | P41595 | 2/20 | 0.73 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.73 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.73 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.73 |
| ▸ | HTR6 | P50406 | 1/20 | 0.73 |
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 | |
|---|---|---|---|---|
| SCHEMBL10674626 | 0.92 | CYP2D6 (0.70) | CYP2D6CHRM2ADRA2ADRD1SLC6A4 | |
| Methapyrilene SCHEMBL19209 | 0.84 | CYP2D6 (1.00) | CYP2D6CHRM2ADRA2ADRD1SLC6A4 | |
| Methapyrilene SCHEMBL745149 | 0.83 | CYP2D6 (0.97) | CYP2D6CHRM2ADRA2ADRD1SLC6A4 | |
| Methapyrilene SCHEMBL498484 | 0.83 | KDM4E (1.00) | CYP2D6CHRM2ADRA2ADRD1SLC6A4 | |
| SCHEMBL7311717 | 0.82 | CYP2D6 (0.68) | CYP2D6CHRM2ADRA2ADRD1SLC6A4 | |
| Methapyrilene SCHEMBL1074644 | 0.82 | CYP2D6 (0.95) | CYP2D6CHRM2ADRA2ADRD1SLC6A4 | |
| SCHEMBL10814760 | 0.79 | CYP2D6 (0.59) | CYP2D6CHRM2ADRA2ADRD1SLC6A4 | |
| Methapyrilene SCHEMBL7121305 | 0.78 | CYP2D6 (0.86) | CYP2D6CHRM2ADRA2ADRD1SLC6A4 | |
| Methapyrilene SCHEMBL28140755 | 0.78 | CYP2D6 (0.86) | CYP2D6CHRM2ADRA2ADRD1SLC6A4 | |
| SCHEMBL21360460 | 0.78 | CYP2D6 (0.46) | CYP2D6CHRM2ADRA2ADRD1SLC6A4 |
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-0262448-B1 | IMIDAZOLYLGUANIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM | HEUMANN PHARMA GMBH & CO (DE) | 1991-12-18 | — | — | EP | disclosed |
| US-4912119-A | Cardiovascular disorders | HEUMANN PHARMA GMBH & CO. (DE) | 1990-03-27 | — | — | US | disclosed |
| EP-0262448-A1 | Imidazolylguanidine derivatives, process for their preparation and medicines containing them | HEUMANN PHARMA GMBH & CO (DE) | 1988-04-06 | — | — | EP | disclosed |