Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 2/20 | 0.50 |
| ▸ | HTR2A | P28223 | 2/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.49 |
| ▸ | HTR6 | P50406 | 3/20 | 0.46 |
| ▸ | HTR7 | P34969 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 5/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | HTR3A | P46098 | 5/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8572082 | 0.86 | HTR3E (0.41) | HTR2AHTR2CHTR6HTR1ADRD2 | |
| SCHEMBL8562645 | 0.85 | DRD2 (0.49) | ADRB1HTR2AHTR2CSLC6A4HTR6 | |
| SCHEMBL8566442 | 0.82 | ADRB1 (0.33) | ADRB1HTR2AHTR2CSLC6A4HTR6 | |
| SCHEMBL8569217 | 0.80 | GRM2 (0.44) | HTR2AHTR6CYP2C9 | |
| SCHEMBL8569105 | 0.79 | DRD2 (0.52) | HTR2CHTR6HTR1ADRD2HTR3A | |
| SCHEMBL8564853 | 0.77 | HTR2A (0.45) | HTR2AHTR2CSLC6A4HTR6HTR7 | |
| SCHEMBL8567130 | 0.77 | HTR1A (0.52) | HTR2CHTR6HTR1ADRD2HTR3A | |
| SCHEMBL2532529 | 0.74 | ADRB1 (0.46) | ADRB1HTR2AHTR2CSLC6A4HTR6 | |
| SCHEMBL19297164 | 0.74 | HTR2A (0.54) | ADRB1HTR2AHTR2CSLC6A4HTR6 | |
| SCHEMBL8879183 | 0.74 | KDM4E (0.52) | HTR2CHTR6HTR7HTR1ADRD2 |
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-0623620-B1 | 5-HT3 Pyrrolopyrazine derivatives | ADIR (FR) | 1998-09-09 | — | — | EP | disclosed |
| US-5599812-A | ANTISEROTONINE AGENTS | ADIR ET COMPAGNIE (FR) | 1997-02-04 | — | — | US | disclosed |
| EP-0623620-A1 | 5-HT3 Pyrrolopyrazine derivatives | ADIR ET COMPAGNIE (FR) | 1994-11-09 | — | — | EP | disclosed |