Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 5/20 | 0.61 |
| ▸ | TOP2A | P11388 | 5/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | HPGD | P15428 | 4/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | ALB | P02768 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.49 |
| ▸ | TUBB | P07437 | 1/20 | 0.49 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.49 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8482299 | 0.89 | TOP2A (0.61) | TOP1TOP2AKDM4ECYP3A4CYP2C9 | |
| SCHEMBL7010950 | 0.87 | CYP3A4 (0.54) | TOP1TOP2AKDM4ECYP3A4CYP2C9 | |
| SCHEMBL7008772 | 0.86 | CYP3A4 (0.61) | TOP1TOP2AKDM4ECYP3A4CYP2C9 | |
| SCHEMBL7004804 | 0.86 | CYP3A4 (0.71) | TOP1TOP2ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL7009205 | 0.85 | CYP3A4 (0.60) | TOP1TOP2ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL8479016 | 0.85 | ALDH1A1 (0.69) | TOP1TOP2ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL7005992 | 0.85 | CYP3A4 (0.58) | TOP1TOP2ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL7004969 | 0.85 | ALDH1A1 (0.69) | TOP1TOP2ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL8484766 | 0.85 | CYP3A4 (0.58) | TOP1TOP2AKDM4ECYP3A4CYP2C9 | |
| SCHEMBL7007374 | 0.85 | CYP3A4 (0.58) | TOP1TOP2ACYP3A4CYP2C9ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5910498-A | NOVEL COMPOUNDS HAVING REDUCED CYTOTOXICITY, PHOTOTOXICITY; TREATING BACTERIAL AND VIRAL INFECTIONS | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1999-06-08 | — | — | US | disclosed |
| EP-0787720-A1 | NOVEL PYRIDONECARBOXYLATE DERIVATIVE OR SALT THEREOF AND ANTIBACTERIAL CONTAINING THE SAME AS ACTIVE INGREDIENT | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1997-08-06 | — | — | EP | disclosed |