Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 8/20 | 0.55 |
| ▸ | HTR1A | P08908 | 5/20 | 0.55 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6823760 | 0.92 | HTR7 (0.45) | HTR7HTR1AMCHR1POLBDRD4 | |
| SCHEMBL6823392 | 0.92 | HTR7 (0.49) | HTR7HTR1APOLBDRD4DRD2 | |
| SCHEMBL6919727 | 0.88 | HTR7 (0.46) | HTR7HTR1APOLBDRD4DRD2 | |
| SCHEMBL6824321 | 0.88 | HTR7 (0.46) | HTR7HTR1APOLBDRD4DRD2 | |
| SCHEMBL6381981 | 0.85 | HTR7 (0.49) | HTR7HTR1APOLBDRD4DRD2 | |
| SCHEMBL6823876 | 0.84 | HTR7 (0.46) | HTR7HTR1AMCHR1POLBDRD4 | |
| SCHEMBL6820545 | 0.84 | HTR7 (0.50) | HTR7HTR1ADRD4DRD2HTR2A | |
| SCHEMBL6451227 | 0.84 | KMT2A (0.48) | HTR7HTR1APOLBHRH3DRD4 | |
| SCHEMBL6823928 | 0.83 | HTR7 (0.55) | HTR7HTR1AMCHR1POLBL3MBTL1 | |
| SCHEMBL6820569 | 0.83 | HTR7 (0.55) | HTR7HTR1AMCHR1POLBL3MBTL1 |
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 |