Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 4/20 | 0.43 |
| ▸ | HTR2C | P28335 | 4/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.43 |
| ▸ | HTR3B | O95264 | 2/20 | 0.43 |
| ▸ | HTR3A | P46098 | 2/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 7/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.41 |
| ▸ | DRD4 | P21917 | 3/20 | 0.38 |
| ▸ | DRD3 | P35462 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8566284 | 0.83 | DRD4 (0.54) | HTR1AHTR2CHTR3EHTR3BHTR3A | |
| SCHEMBL8563995 | 0.83 | DRD2 (0.54) | HTR1AHTR2CDRD4DRD3DRD2 | |
| SCHEMBL8572094 | 0.83 | HTR1A (0.48) | HTR1AHTR2CHTR3EHTR3BHTR3A | |
| SCHEMBL8562733 | 0.81 | DRD2 (0.49) | HTR1AHTR2CHTR3EHTR3BHTR3A | |
| SCHEMBL8571687 | 0.80 | HTR1A (0.49) | HTR1AHTR2CHTR3EHTR3BHTR3A | |
| SCHEMBL8565094 | 0.80 | DHFR (0.40) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL8566350 | 0.78 | KDM4E (0.52) | HTR1AHTR2CHTR3EHTR3BHTR3A | |
| SCHEMBL8562645 | 0.78 | DRD2 (0.49) | HTR1AHTR2CHTR3ADRD4DRD3 | |
| SCHEMBL8563723 | 0.78 | CNR2 (0.39) | HTR2CMAPK10DRD4DRD3DRD2 | |
| SCHEMBL8565346 | 0.78 | MEN1 (0.49) | HTR1AHTR2C |
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 |