Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.51 |
| ▸ | HTR2B | P41595 | 3/20 | 0.51 |
| ▸ | HTR2C | P28335 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | USP2 | O75604 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.48 |
| ▸ | DRD3 | P35462 | 2/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9472697 | 1.00 | HTR2A (0.51) | HTR2AHTR2BHTR2CCYP3A4USP2 | |
| SCHEMBL9816878 | 0.85 | HTR2A (0.56) | HTR2AHTR2BHTR2CCYP3A4USP2 | |
| SCHEMBL9816873 | 0.85 | HTR2A (0.56) | HTR2AHTR2BHTR2CCYP3A4USP2 | |
| SCHEMBL9155234 | 0.84 | MEN1 (0.62) | HTR2AHTR2BHTR2CCYP3A4USP2 | |
| SCHEMBL9472455 | 0.84 | MEN1 (0.62) | HTR2AHTR2BHTR2CCYP3A4USP2 | |
| Hydrochloric Acid SCHEMBL9472496 | 0.83 | MEN1 (0.61) | HTR2AHTR2BHTR2CCYP3A4USP2 | |
| Hydrochloric Acid SCHEMBL9472489 | 0.83 | MEN1 (0.61) | HTR2AHTR2BHTR2CCYP3A4USP2 | |
| SCHEMBL9472615 | 0.81 | HTR2A (0.52) | HTR2AHTR2BHTR2CCYP3A4USP2 | |
| SCHEMBL9155414 | 0.81 | HTR2A (0.52) | HTR2AHTR2BHTR2CCYP3A4USP2 | |
| Hydrochloric Acid SCHEMBL9472549 | 0.81 | CYP3A4 (0.52) | HTR2AHTR2BHTR2CCYP3A4USP2 |
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-0543713-B1 | Ethanolamine benzoate derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR (FR) | 1995-02-22 | — | — | EP | disclosed |
| US-5266591-A | For treatment of abnormal metabolism | ADIR ET COMPAGNIE (FR) | 1993-11-30 | — | — | US | disclosed |
| EP-0543713-A1 | Ethanolamine benzoate derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1993-05-26 | — | — | EP | disclosed |