Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | TOP2A | P11388 | 14/20 | 0.51 |
| ▸ | TOP1 | P11387 | 4/20 | 0.51 |
| ▸ | TOP2B | Q02880 | 10/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6580734 | 0.92 | CYP3A4 (0.56) | CYP3A4CYP2C9TOP2ATOP1TOP2B | |
| SCHEMBL7004810 | 0.91 | CYP3A4 (0.68) | CYP3A4CYP2C9TOP2ATOP1TOP2B | |
| SCHEMBL6578831 | 0.91 | CYP3A4 (0.54) | CYP3A4CYP2C9TOP2ATOP1TOP2B | |
| SCHEMBL19729386 | 0.88 | CYP3A4 (0.51) | CYP3A4CYP2C9TOP2ATOP1TOP2B | |
| SCHEMBL7013849 | 0.86 | CYP3A4 (0.66) | CYP3A4CYP2C9TOP2ATOP1TOP2B | |
| SCHEMBL7004804 | 0.84 | CYP3A4 (0.71) | CYP3A4CYP2C9TOP2ATOP1TOP2B | |
| SCHEMBL6578454 | 0.84 | KCNH2 (0.48) | CYP3A4CYP2C9TOP2ATOP1TOP2B | |
| SCHEMBL7014529 | 0.84 | ALDH1A1 (0.68) | CYP3A4CYP2C9TOP2ATOP1TOP2B | |
| SCHEMBL8482368 | 0.84 | ALDH1A1 (0.68) | CYP3A4CYP2C9TOP2ATOP1TOP2B | |
| SCHEMBL7008959 | 0.84 | CYP3A4 (0.58) | CYP3A4CYP2C9TOP2ATOP1TOP2B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0897919-B1 | NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND ANTIBACTERIAL AGENTS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | WAKUNAGA PHARMA CO LTD (JP) | 2004-06-16 | — | — | EP | disclosed |
| US-6211375-B1 | IMPROVED INTESTINAL ABSORPTION | WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) | 2001-04-03 | — | — | US | disclosed |
| EP-0897919-A1 | NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND ANTIBACTERIAL AGENTS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) | 1999-02-24 | — | — | EP | disclosed |