Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.55 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.55 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | TOP2A | P11388 | 12/20 | 0.51 |
| ▸ | TOP1 | P11387 | 3/20 | 0.51 |
| ▸ | TOP2B | Q02880 | 7/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.49 |
| ▸ | FLT4 | P35916 | 1/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
| ▸ | RARB | P10826 | 1/20 | 0.49 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30626285 | 1.00 | ALDH1A1 (0.55) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL29080644 | 0.91 | KDM4E (0.58) | ALDH1A1POLBKMT2ATOP2ATOP1 | |
| SCHEMBL30626277 | 0.91 | KDM4E (0.58) | ALDH1A1POLBKMT2ATOP2ATOP1 | |
| SCHEMBL10767292 | 0.90 | ALDH1A1 (0.69) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL30626290 | 0.88 | KCNH2 (0.57) | ALDH1A1POLBOPRM1KMT2ATOP2A | |
| SCHEMBL29080650 | 0.88 | KCNH2 (0.57) | ALDH1A1POLBOPRM1KMT2ATOP2A | |
| SCHEMBL10769256 | 0.84 | TOP2A (0.59) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL4365474 | 0.84 | LMNA (0.55) | ALDH1A1POLBKMT2ATOP2ATOP1 | |
| SCHEMBL10765246 | 0.83 | ALDH1A1 (0.47) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL9734489 | 0.82 | ALDH1A1 (0.79) | ALDH1A1POLBCHRM2CHRM1OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116606279-A | Fluoroquinolone compound and preparation method and application thereof | 广东工业大学 | 2023-08-18 | — | — | CN | disclosed |