Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | STAT3 | P40763 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10945498 | 0.86 | CYP2C9 (0.34) | ALDH1A1CYP2C9CYP2C19STAT3 | |
| SCHEMBL10945491 | 0.86 | CYP2C9 (0.34) | ALDH1A1CYP2C9CYP2C19STAT3 | |
| SCHEMBL11415929 | 0.85 | DGAT2 (0.37) | SMN1; SMN2NPSR1MTNR1AMTNR1BCYP2C9 | |
| SCHEMBL7149816 | 0.85 | DGAT2 (0.37) | SMN1; SMN2NPSR1MTNR1AMTNR1BCYP2C9 | |
| SCHEMBL10946179 | 0.85 | DGAT2 (0.37) | SMN1; SMN2NPSR1MTNR1AMTNR1BCYP2C9 | |
| SCHEMBL7154211 | 0.85 | DGAT2 (0.37) | SMN1; SMN2NPSR1MTNR1AMTNR1BCYP2C9 | |
| SCHEMBL11420286 | 0.81 | — | — | |
| SCHEMBL11420289 | 0.81 | — | — | |
| SCHEMBL11882545 | 0.78 | KDM4E (0.36) | CYP2C19 | |
| SCHEMBL23672482 | 0.78 | PSEN1 (0.32) | SMN1; SMN2NPSR1MTNR1AMTNR1B |
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-4526960-A | Pharmaceuticals | HOFFMANN-LA ROCHE INC. (US) | 1985-07-02 | — | — | US | disclosed |
| US-4024333-A | Synthesis of daunosamine hydrochloride from a D-mannose starting material | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH, EDUCATION AND WELFARE (US) | 1977-05-17 | — | — | US | disclosed |