Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 8/20 | 0.64 |
| ▸ | HTR2C | P28335 | 5/20 | 0.53 |
| ▸ | HTR2A | P28223 | 4/20 | 0.49 |
| ▸ | HTR7 | P34969 | 2/20 | 0.49 |
| ▸ | HTR6 | P50406 | 2/20 | 0.49 |
| ▸ | DRD2 | P14416 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | MTOR | P42345 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8947762 | 0.95 | HTR1A (0.66) | HTR1AHTR2CHTR2ACYP1A2CYP3A4 | |
| SCHEMBL8948011 | 0.90 | HTR1A (0.60) | HTR1AHTR2CHTR2AHTR7HTR6 | |
| SCHEMBL8948018 | 0.86 | HTR1A (0.53) | HTR1AHTR2CHTR2AHTR7HTR6 | |
| SCHEMBL8947779 | 0.86 | KDM4E (0.54) | HTR1AHTR2CHTR2AHTR7CYP1A2 | |
| SCHEMBL8947985 | 0.85 | KDM4E (0.58) | HTR1AHTR2CHTR2AHTR7CYP1A2 | |
| SCHEMBL8948062 | 0.83 | HTR1A (0.69) | HTR1AHTR2CHTR7 | |
| SCHEMBL8947935 | 0.83 | HTR2A (0.59) | HTR1AHTR2CHTR2AHTR7HTR6 | |
| SCHEMBL8947974 | 0.82 | SIGMAR1 (0.64) | HTR2CHTR2AHTR7HTR6CYP1A2 | |
| SCHEMBL8948192 | 0.82 | HTR1A (0.65) | HTR1AHTR2CHTR2AHTR7 | |
| SCHEMBL8948104 | 0.81 | HTR2A (0.52) | HTR1AHTR2CHTR2ACYP1A2CYP3A4 |
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-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 |