Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 9/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | HPGD | P15428 | 5/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.60 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.58 |
| ▸ | CLK2 | P49760 | 1/20 | 0.58 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL30626273 | 1.00 | TOP1 (0.62) | TOP1KCNH2KDM4EALDH1A1HPGD | |
| Water SCHEMBL9774065 | 0.91 | KCNH2 (0.62) | TOP1KCNH2KDM4EALDH1A1HPGD | |
| Water SCHEMBL9774060 | 0.91 | KCNH2 (0.62) | TOP1KCNH2KDM4EALDH1A1HPGD | |
| Fluoride Ion SCHEMBL9773943 | 0.88 | TOP1 (0.74) | TOP1KCNH2KDM4EALDH1A1HPGD | |
| SCHEMBL30626297 | 0.88 | ALDH1A1 (0.61) | TOP1KCNH2KDM4EALDH1A1HPGD | |
| SCHEMBL29080633 | 0.88 | ALDH1A1 (0.61) | TOP1KCNH2KDM4EALDH1A1HPGD | |
| SCHEMBL29080627 | 0.88 | ALDH1A1 (0.61) | TOP1KCNH2KDM4EALDH1A1HPGD | |
| SCHEMBL30626264 | 0.88 | ALDH1A1 (0.61) | TOP1KCNH2KDM4EALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL9773821 | 0.87 | TOP1 (0.57) | TOP1KCNH2KDM4EALDH1A1HPGD | |
| SCHEMBL9773961 | 0.87 | TOP1 (0.73) | TOP1KCNH2KDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-116606279-A | Fluoroquinolone compound and preparation method and application thereof | 广东工业大学 | 2023-08-18 | — | — | CN | claimed |
| CN-116606279-A | Fluoroquinolone compound and preparation method and application thereof | 广东工业大学 | 2023-08-18 | — | — | CN | disclosed |