Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 14/20 | 0.71 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL20258407 | 0.93 | TOP1 (0.78) | TOP1KCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL20258459 | 0.92 | TOP1 (0.74) | TOP1KCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL20258414 | 0.90 | TOP1 (0.77) | TOP1KCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL20258368 | 0.89 | TOP1 (0.89) | TOP1KCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL20258487 | 0.89 | TOP1 (0.79) | TOP1KCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL20258364 | 0.86 | TOP1 (0.84) | TOP1KCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL20258412 | 0.85 | TOP1 (0.76) | TOP1KCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL20258454 | 0.84 | TOP1 (0.87) | TOP1KCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL20258378 | 0.83 | TOP1 (1.00) | TOP1KCNH2 | |
| SCHEMBL20258363 | 0.83 | TOP1 (1.00) | TOP1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018107112-A1 | QUINOLONE-BASED COMPOUNDS WITH ANTICANCER ACTIVITY | UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) | 2018-06-14 | — | — | WO | disclosed |