Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.57 |
| ▸ | HTR2C | P28335 | 3/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.57 |
| ▸ | HTR1A | P08908 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.57 |
| ▸ | DRD2 | P14416 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | HTR7 | P34969 | 2/20 | 0.57 |
| ▸ | HTR6 | P50406 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.57 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.57 |
| ▸ | DRD1 | P21728 | 1/20 | 0.57 |
| ▸ | DRD4 | P21917 | 1/20 | 0.57 |
| ▸ | HTR1D | P28221 | 1/20 | 0.57 |
| ▸ | HTR1B | P28222 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL11707845 | 0.94 | KDM4E (0.58) | HTR2ACYP1A2CYP3A4CYP2D6KDM4E | |
| SCHEMBL8947975 | 0.91 | SIGMAR1 (0.56) | HTR2ADRD2DRD4SIGMAR1 | |
| SCHEMBL8948100 | 0.89 | SIGMAR1 (0.48) | DRD2DRD4SIGMAR1 | |
| SCHEMBL8948034 | 0.87 | HTR2A (0.52) | HTR2AHTR2CCYP1A2CYP3A4HTR1A | |
| SCHEMBL8947958 | 0.87 | SMN1; SMN2 (0.55) | LMNAMAPT | |
| SCHEMBL8947939 | 0.85 | DRD2 (0.53) | DRD2DRD4KCNH2SIGMAR1 | |
| SCHEMBL8948150 | 0.83 | HTR2A (0.55) | HTR2AHTR2CDRD2HTR7HTR6 | |
| SCHEMBL8948051 | 0.83 | HTR2A (0.55) | HTR2AHTR2CDRD2HTR7HTR6 | |
| SCHEMBL8947974 | 0.83 | SIGMAR1 (0.64) | HTR2AHTR2CCYP1A2CYP3A4HTR7 | |
| SCHEMBL8947877 | 0.83 | KCNH2 (0.56) | DRD2DRD4KCNH2SIGMAR1TSHR |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 | claimed |
| JP-7002850-A | — | — | None | — | — | JP | disclosed |
| 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 |
| JP-H072850-A | NEW (ARYL(ALKYL)CARBONYL)-HETEROCYCLIC COMPOUND | ADIR | 1995-01-06 | — | — | JP | 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 |