Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 8/20 | 0.52 |
| ▸ | HTR2C | P28335 | 3/20 | 0.52 |
| ▸ | HTR7 | P34969 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | THPO | P40225 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8948192 | 0.90 | HTR1A (0.65) | HTR1AHTR2CHTR7 | |
| SCHEMBL8947933 | 0.88 | HTR1A (0.66) | HTR1AHTR2CHTR7CYP3A4CYP2D6 | |
| SCHEMBL7765360 | 0.81 | HTR2A (0.47) | HTR1AHTR2CHTR7ALDH1A1DRD2 | |
| SCHEMBL8948013 | 0.81 | HTR1A (0.56) | HTR1AHTR2CHTR7CYP3A4CYP2D6 | |
| SCHEMBL8948074 | 0.81 | HTR1A (0.53) | HTR1AHTR2CHTR7CYP3A4CYP2D6 | |
| SCHEMBL8948011 | 0.78 | HTR1A (0.60) | HTR1AHTR2CHTR7CYP3A4CYP2D6 | |
| SCHEMBL8948150 | 0.78 | HTR2A (0.55) | HTR2CHTR7ALDH1A1DRD2LMNA | |
| SCHEMBL8947994 | 0.77 | CYP1A2 (0.51) | HTR1AHTR2CHTR7ALDH1A1DRD2 | |
| SCHEMBL8947779 | 0.77 | KDM4E (0.54) | HTR1AHTR2CHTR7CYP3A4CYP2D6 | |
| SCHEMBL8948137 | 0.77 | HTR1A (0.70) | HTR1AHTR2CHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| US-5534517-A | (Aryl(alkyl)carbonyl)-heterocyclic compounds and their use in the treatment of anxiety and depression | ADIR ET COMPAGNIE (FR) | 1996-07-09 | — | — | US | disclosed |
| US-5387586-A | Analgesics, nervous system disorders | ADIR ET COMPAGNIE (FR) | 1995-02-07 | — | — | US | disclosed |
| EP-0613898-A1 | Aryl or arylalkyl-carbonyl heterocyclic derivatives, processes for their preparation and compositions containing them | ADIR ET COMPAGNIE (FR) | 1994-09-07 | — | — | EP | disclosed |