Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 6/20 | 0.45 |
| ▸ | HTR2C | P28335 | 6/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 6/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 3/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27363223 | 0.91 | HTR2A (0.49) | HTR2AHTR2CCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959713 | 0.91 | HTR2A (0.49) | HTR2AHTR2CCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959561 | 0.91 | HTR2A (0.49) | HTR2AHTR2CCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959864 | 0.91 | HTR2A (0.49) | HTR2AHTR2CCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959551 | 0.90 | AR (0.39) | HTR2AHTR2CCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959652 | 0.89 | HTR2C (0.40) | HTR2AHTR2CCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959562 | 0.87 | HTR2C (0.46) | HTR2AHTR2CNPY5RARMTNR1A | |
| SCHEMBL8959678 | 0.87 | HTR2C (0.46) | HTR2AHTR2CNPY5RARGRIN2B | |
| SCHEMBL8959479 | 0.87 | HTR2C (0.46) | HTR2AHTR2CNPY5RARGRIN2B | |
| SCHEMBL27356666 | 0.87 | HTR2C (0.46) | HTR2AHTR2CNPY5RARMTNR1A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5494928-A | FOR CENTRAL NERVOUS SYSTEM DISORDERS, BLOCKING SEROTONIN RECEPTORS, ANTIDEPRESSANTS | HOFFMANN-LA ROCHE INC. (US) | 1996-02-27 | — | — | US | disclosed |