Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 5/20 | 0.45 |
| ▸ | HTR1A | P08908 | 3/20 | 0.45 |
| ▸ | DRD2 | P14416 | 5/20 | 0.42 |
| ▸ | HTR2A | P28223 | 5/20 | 0.42 |
| ▸ | DRD3 | P35462 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6820568 | 0.92 | HTR7 (0.55) | HTR7HTR1ADRD2HTR2APOLB | |
| SCHEMBL6823876 | 0.92 | HTR7 (0.46) | HTR7HTR1ADRD2HTR2ADRD3 | |
| SCHEMBL6823392 | 0.92 | HTR7 (0.49) | HTR7HTR1ADRD2HTR2APOLB | |
| SCHEMBL6824321 | 0.88 | HTR7 (0.46) | HTR7HTR1ADRD2HTR2APOLB | |
| SCHEMBL6919727 | 0.88 | HTR7 (0.46) | HTR7HTR1ADRD2HTR2APOLB | |
| SCHEMBL6462598 | 0.85 | HTR7 (0.54) | HTR7HTR1ADRD2HTR2ADRD3 | |
| SCHEMBL6458101 | 0.85 | HTR7 (0.54) | HTR7HTR1ADRD2HTR2ADRD3 | |
| SCHEMBL6381981 | 0.84 | HTR7 (0.49) | HTR7HTR1ADRD2HTR2APOLB | |
| SCHEMBL6466592 | 0.84 | HTR7 (0.55) | HTR7HTR1ADRD2HTR2ADRD3 | |
| SCHEMBL6462987 | 0.84 | HTR7 (0.47) | HTR7HTR1APOLBADRA1DADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004076444-A2 | NOVEL HYDROXYCOUMARANONE DERIVATIVES AS ANTITUMOR AND ANTIMETASTATIC | F. HOFFMANN-LA ROCHE AG (CH) | 2004-09-10 | — | — | WO | claimed |
| WO-2004076444-A2 | NOVEL HYDROXYCOUMARANONE DERIVATIVES AS ANTITUMOR AND ANTIMETASTATIC | F. HOFFMANN-LA ROCHE AG (CH) | 2004-09-10 | — | — | WO | disclosed |