Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.51 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.47 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.47 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.47 |
| ▸ | MATK | P42679 | 1/20 | 0.47 |
| ▸ | MAPKAPK3 | Q16644 | 1/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.47 |
| ▸ | TOP1 | P11387 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TOP2A | P11388 | 11/20 | 0.44 |
| ▸ | TOP2B | Q02880 | 8/20 | 0.44 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | GSK3A | P49840 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.42 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.42 |
| ▸ | CSNK1G3 | Q9Y6M4 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7006724 | 1.00 | KCNH2 (0.51) | KCNH2HRH3DYRK1APIM3RPS6KB1 | |
| SCHEMBL7011812 | 0.93 | KCNH2 (0.47) | KCNH2HRH3DYRK1APIM3RPS6KB1 | |
| SCHEMBL7012357 | 0.90 | TOP1 (0.46) | DYRK1APIM3TOP1KMT2ATOP2A | |
| SCHEMBL8480759 | 0.90 | TOP1 (0.46) | DYRK1APIM3TOP1KMT2ATOP2A | |
| SCHEMBL8625264 | 0.88 | KMT2A (0.60) | KCNH2HRH3DYRK1APIM3RPS6KB1 | |
| Hydrochloric Acid SCHEMBL8112209 | 0.87 | KMT2A (0.59) | KCNH2HRH3DYRK1APIM3RPS6KB1 | |
| SCHEMBL7009374 | 0.84 | TOP1 (0.59) | DYRK1APIM3TOP1KMT2ATOP2A | |
| SCHEMBL8482062 | 0.84 | TOP1 (0.59) | DYRK1APIM3TOP1KMT2ATOP2A | |
| Hydrochloric Acid SCHEMBL8110971 | 0.83 | KCNH2 (0.51) | KCNH2HRH3DYRK1APIM3RPS6KB1 | |
| SCHEMBL7008071 | 0.83 | CYP3A4 (0.41) | KCNH2HRH3TOP1KMT2ATOP2A |
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 1 patent. 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 |