Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 8/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 8/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14778972 | 1.00 | HCRTR1 (0.35) | HCRTR1HCRTR2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL14779602 | 0.79 | CHRNB2 (0.37) | HSD17B10 | |
| SCHEMBL31259970 | 0.79 | CHRNB2 (0.37) | HSD17B10 | |
| SCHEMBL31259960 | 0.77 | CYP11B1 (0.53) | — | |
| SCHEMBL14780179 | 0.77 | CYP11B1 (0.53) | — | |
| SCHEMBL14778971 | 0.73 | HCRTR1 (0.34) | HCRTR1HCRTR2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL14784304 | 0.73 | HCRTR1 (0.34) | HCRTR1HCRTR2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL21535328 | 0.72 | HCRTR1 (0.35) | HCRTR1HCRTR2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL14778970 | 0.72 | HCRTR1 (0.33) | HCRTR1HCRTR2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL14784303 | 0.72 | HCRTR1 (0.33) | HCRTR1HCRTR2CYP3A4CYP2C9CYP2C19 |
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-2755963-A1 | NEW DIHYDROQUINOLINE-2-ONE DERIVATIVES | F.HOFFMANN-LA ROCHE AG (CH) | 2014-07-23 | — | — | EP | disclosed |
| WO-2013037779-A1 | NEW DIHYDROQUINOLINE-2-ONE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2013-03-21 | — | — | WO | disclosed |