Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | TOP2A | P11388 | 12/20 | 0.43 |
| ▸ | TOP2B | Q02880 | 8/20 | 0.43 |
| ▸ | TOP1 | P11387 | 4/20 | 0.43 |
| ▸ | STAT3 | P40763 | 1/20 | 0.42 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.42 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7010194 | 0.91 | CACNA1F (0.51) | CYP3A4CYP2C9TOP2ATOP2BTOP1 | |
| SCHEMBL6576258 | 0.87 | CYP3A4 (0.46) | CYP3A4CYP2C9TOP2ATOP2BTOP1 | |
| SCHEMBL7008959 | 0.85 | CYP3A4 (0.58) | CYP3A4CYP2C9TOP2ATOP2BTOP1 | |
| SCHEMBL7011332 | 0.84 | TOP2A (0.53) | TOP2ATOP2BTOP1CACNA1FPOLB | |
| SCHEMBL8478277 | 0.84 | TOP2A (0.53) | TOP2ATOP2BTOP1CACNA1FPOLB | |
| SCHEMBL7008071 | 0.84 | CYP3A4 (0.41) | CYP3A4CYP2C9TOP2ATOP2BTOP1 | |
| SCHEMBL7007135 | 0.84 | STAT3 (0.54) | TOP2ATOP2BTOP1STAT3POLB | |
| SCHEMBL7005373 | 0.83 | CYP3A4 (0.53) | CYP3A4CYP2C9TOP2ATOP2BTOP1 | |
| SCHEMBL7012569 | 0.82 | CYP3A4 (0.56) | CYP3A4CYP2C9TOP2ATOP2BTOP1 | |
| SCHEMBL6580734 | 0.81 | CYP3A4 (0.56) | CYP3A4CYP2C9TOP2ATOP2BTOP1 |
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-0787720-B1 | PYRIDONECARBOXYLATE DERIVATIVE OR SALT THEREOF AND ANTIBACTERIAL CONTAINING THE SAME AS ACTIVE INGREDIENT | WAKUNAGA SEIYAKU KK (JP) | 2003-07-16 | — | — | EP | disclosed |
| US-5910498-A | NOVEL COMPOUNDS HAVING REDUCED CYTOTOXICITY, PHOTOTOXICITY; TREATING BACTERIAL AND VIRAL INFECTIONS | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1999-06-08 | — | — | US | disclosed |