Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 7/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.46 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.46 |
| ▸ | MLNR | O43193 | 1/20 | 0.46 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11448375 | 0.97 | CHRM3 (0.48) | CHRM3HRH3SLC22A1MLNRNR1I2 | |
| SCHEMBL11447617 | 0.82 | CHRNB4 (0.52) | CHRM3HRH3SLC22A1MLNRNR1I2 | |
| SCHEMBL11449643 | 0.79 | CHRNB4 (0.55) | CHRM3HRH3SLC22A1MLNRNR1I2 | |
| SCHEMBL11448270 | 0.79 | HRH3 (0.55) | CHRM3HRH3SLC22A1MLNRNR1I2 | |
| SCHEMBL11458039 | 0.79 | HRH3 (0.57) | HRH3CHRNB4CHRNA3 | |
| Hydrochloric Acid SCHEMBL11449305 | 0.78 | SIGMAR1 (0.54) | CHRM3HRH3SLC22A1MLNRNR1I2 | |
| SCHEMBL14578281 | 0.78 | LTA4H (0.55) | CHRM3HRH3SLC22A1MLNRNR1I2 | |
| SCHEMBL11466404 | 0.77 | TSHR (0.56) | CHRM3HRH3SLC22A1MLNRNR1I2 | |
| SCHEMBL11455704 | 0.77 | HTR2A (0.45) | CHRM3HRH3HTR2ASIGMAR1CHRNB2 | |
| SCHEMBL11447713 | 0.77 | HTR2A (0.45) | CHRM3HRH3HTR2ASIGMAR1CHRNB2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4225608-A | ANTIDEPRESSANTS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1980-09-30 | — | — | US | disclosed |
| EP-0004288-A2 | Phenoxyalkyl amines, pharmaceutical compositions containing them, and process for their preparation | MERCK PATENT GmbH (DE) | 1979-10-03 | — | — | EP | disclosed |