Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL320082 | 0.82 | CYP4F2 (0.35) | ALDH1A1LMNAPOLBCYP2C19CYP4F2 | |
| Boric Acid SCHEMBL28492132 | 0.77 | CYP4F2 (0.34) | ALDH1A1LMNAPOLBCYP2C19CYP4F2 | |
| SCHEMBL27630999 | 0.77 | ALDH1A1 (0.38) | ALDH1A1LMNAPOLBCYP2C19CYP4F2 | |
| SCHEMBL30483365 | 0.76 | CYP4F2 (0.36) | ALDH1A1LMNAPOLBCYP2C19CYP4F2 | |
| SCHEMBL30241924 | 0.69 | ALDH1A1 (0.35) | ALDH1A1LMNAPOLBCYP2C19CYP4F2 | |
| SCHEMBL30241921 | 0.69 | ALDH1A1 (0.39) | ALDH1A1LMNAPOLBCYP2C19CYP4F2 | |
| SCHEMBL31632653 | 0.69 | — | — | |
| SCHEMBL20590813 | 0.68 | CYP2C19 (0.38) | ALDH1A1LMNAPOLBCYP2C19CYP4F2 | |
| SCHEMBL5860682 | 0.68 | CD274 (0.33) | ALDH1A1LMNAPOLBCYP2C19CYP4F2 | |
| SCHEMBL2010151 | 0.68 | ALDH1A1 (0.34) | ALDH1A1LMNAPOLBCYP2C19CYP4F2 |
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-2023005928-A1 | 8-OXO-3-AZABICYCLO[3.2.1]OCTANE COMPOUND OR SALT THEREOF, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海辉启生物医药科技有限公司 | 2023-02-02 | — | — | WO | disclosed |