Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.40 |
| ▸ | CHRNA2 | Q15822 | 2/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.40 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | HTR3B | O95264 | 1/20 | 0.40 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.40 |
| ▸ | CHRNG | P07510 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | CHRNA5 | P30532 | 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 | |
|---|---|---|---|---|
| SCHEMBL2938113 | 0.84 | CYP2A6 (0.41) | ALDH1A1CHRNB2CHRNA4CYP2A6LMNA | |
| SCHEMBL31336364 | 0.81 | GAA (0.33) | TDP1CYP3A4 | |
| SCHEMBL12989225 | 0.80 | POLB (0.39) | LMNATDP1CYP2D6TSHR | |
| SCHEMBL120847 | 0.80 | ALDH1A1 (0.38) | ALDH1A1CHRNA7CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL3565375 | 0.78 | TACR1 (0.33) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL2075021 | 0.74 | ALDH1A1 (0.41) | ALDH1A1CHRNA7LMNATDP1MAPT | |
| SCHEMBL3458156 | 0.73 | ACHE (0.35) | ALDH1A1 | |
| SCHEMBL27549548 | 0.73 | ALDH1A1 (0.42) | ALDH1A1CYP2A6MAPTKDM4ECYP2E1 | |
| SCHEMBL4078174 | 0.72 | MAPT (0.36) | ALDH1A1CHRNB2CHRNA4CYP2A6LMNA | |
| SCHEMBL15669151 | 0.72 | MAPT (0.47) | ALDH1A1CYP2A6LMNAMAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024232325-A1 | DIOXAZABOROCANE DERIVATIVE | 国立大学法人 東京医科歯科大学 | 2024-11-14 | — | — | WO | claimed |
| WO-2024232325-A1 | DIOXAZABOROCANE DERIVATIVE | 国立大学法人 東京医科歯科大学 | 2024-11-14 | — | — | WO | disclosed |