Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 17/20 | 0.54 |
| ▸ | HTR2C | P28335 | 16/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 12/20 | 0.54 |
| ▸ | DRD2 | P14416 | 12/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL27495582 | 0.83 | HTR2A (0.58) | HTR2AHTR2CKCNH2DRD2KDM4E | |
| SCHEMBL12891507 | 0.79 | HTR2A (0.62) | HTR2AHTR2CKCNH2DRD2KDM4E | |
| SCHEMBL2547020 | 0.78 | KCNH2 (0.63) | HTR2AHTR2CKCNH2DRD2 | |
| Hydrochloric Acid SCHEMBL2545634 | 0.77 | KCNH2 (0.61) | HTR2AHTR2CKCNH2DRD2 | |
| SCHEMBL30323103 | 0.77 | HTR2A (0.53) | HTR2AHTR2CKCNH2DRD2KDM4E | |
| SCHEMBL24008750 | 0.77 | HTR2A (0.53) | HTR2AHTR2CKCNH2DRD2KDM4E | |
| Hydrochloric Acid SCHEMBL2548134 | 0.77 | KCNH2 (0.61) | HTR2AHTR2CKCNH2DRD2 | |
| SCHEMBL7700904 | 0.76 | IDO1 (0.58) | HTR2AHTR2CKCNH2DRD2KDM4E | |
| SCHEMBL27787800 | 0.74 | HTR2A (0.56) | HTR2AHTR2CKCNH2DRD2 | |
| SCHEMBL5827122 | 0.74 | HTR2A (0.59) | HTR2AHTR2CKCNH2DRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1685100-A1 | NOVEL 1, 3-DISUBSTITUTED AZETIDINE DERIVATIVES FOR USE AS 5HT2A RECEPTOR LIGANDS | Merck Sharp & Dohme Limited (GB) | 2006-08-02 | — | — | EP | disclosed |
| WO-2005047246-A1 | NOVEL 1, 3-DISUBSTITUTED AZETIDINE DEIVATIVES FOR USE AS 5HT2A RECEPTOR LIGANDS | MERCK SHARP & DOHME LIMITED (GB) | 2005-05-26 | — | — | WO | disclosed |