Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 5/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.48 |
| ▸ | NR2E1 | Q9Y466 | 4/20 | 0.48 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.48 |
| ▸ | HTR2B | P41595 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HTR2A | P28223 | 3/20 | 0.48 |
| ▸ | HTR2C | P28335 | 3/20 | 0.48 |
| ▸ | HTR6 | P50406 | 3/20 | 0.48 |
| ▸ | SCN1A | P35498 | 2/20 | 0.48 |
| ▸ | SLC10A1 | Q14973 | 2/20 | 0.48 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.48 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HTR1A | P08908 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10505283 | 0.88 | ADRB1 (0.53) | CYP2D6ADRB2ADRB1SIGMAR1NR2E1 | |
| SCHEMBL10503702 | 0.84 | CYP2D6 (0.49) | CYP2D6ADRB2ADRB1SIGMAR1NR2E1 | |
| SCHEMBL10503105 | 0.84 | ADRB2 (0.50) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| Fumaric Acid SCHEMBL10593310 | 0.81 | ADRB2 (0.47) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL10506877 | 0.80 | L3MBTL1 (0.48) | ADRB2ADRB1ADRB3ALDH1A1CASR | |
| SCHEMBL10593198 | 0.79 | CASR (0.51) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL10503571 | 0.79 | L3MBTL1 (0.38) | CYP2D6ADRB2ADRB1ADRB3 | |
| SCHEMBL10503014 | 0.79 | CYP2D6 (0.48) | CYP2D6ADRB2ADRB1SIGMAR1NR2E1 | |
| SCHEMBL10503124 | 0.79 | ADRB1 (0.54) | CYP2D6ADRB2ADRB1SIGMAR1NR2E1 | |
| SCHEMBL10503274 | 0.77 | MEN1 (0.47) | CYP2D6ADRB2ADRB1SIGMAR1NR2E1 |
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-0200915-B1 | AMINOPROPANOL DERIVATIVES, PROCESS FOR THEIR PREPARATION, THEIR USE AND MEDICINES CONTAINING THEM | Roche Diagnostics GmbH (DE) | 1989-09-27 | — | — | EP | disclosed |
| US-4863949-A | CARDIOVASCULAR DISORDER TREATMENT | BOEHRINGER MANNHEIM GMBH (DE) | 1989-09-05 | — | — | US | disclosed |
| EP-0200915-A1 | Aminopropanol derivatives, process for their preparation, their use and medicines containing them | Roche Diagnostics GmbH (DE) | 1986-11-12 | — | — | EP | disclosed |