Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | GSK3B | P49841 | 13/20 | 0.43 |
| ▸ | TOP2A | P11388 | 1/20 | 0.39 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7004180 | 0.88 | CYP3A4 (0.57) | CYP3A4CYP2C9GSK3BTOP2ATOP2B | |
| SCHEMBL7012892 | 0.85 | CYP3A4 (0.52) | CYP3A4CYP2C9GSK3BTOP2ATOP2B | |
| SCHEMBL7007782 | 0.85 | CYP2C9 (0.54) | CYP3A4CYP2C9GSK3BTOP2ATOP2B | |
| SCHEMBL7007305 | 0.85 | CYP2C9 (0.66) | CYP3A4CYP2C9GSK3BTOP2ATOP2B | |
| SCHEMBL7858473 | 0.83 | CYP3A4 (0.52) | CYP3A4CYP2C9GSK3BTOP2ATOP2B | |
| SCHEMBL7009597 | 0.83 | GSK3B (0.44) | GSK3BTOP2ATOP2BPIM1ALDH1A1 | |
| SCHEMBL7858346 | 0.83 | CYP3A4 (0.61) | CYP3A4CYP2C9GSK3BTOP2ATOP2B | |
| SCHEMBL7857527 | 0.82 | CYP3A4 (0.50) | CYP3A4CYP2C9GSK3BTOP2ATOP2B | |
| SCHEMBL7005127 | 0.81 | CYP2C9 (0.58) | CYP3A4CYP2C9GSK3BTOP2ATOP2B | |
| SCHEMBL7861219 | 0.80 | CYP3A4 (0.75) | CYP3A4CYP2C9GSK3BTOP2ATOP2B |
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-0945435-B1 | NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | WAKUNAGA PHARMA CO LTD (JP) | 2003-08-13 | — | — | EP | disclosed |
| US-6136823-A | BACTERICIDES OR VIRICIDES | WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) | 2000-10-24 | — | — | US | disclosed |
| EP-0945435-A1 | NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) | 1999-09-29 | — | — | EP | disclosed |