Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.30 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.30 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL29265102 | 0.99 | CHRM2 (0.43) | ALDH1A1TSHRCHRM2CA1CA2 | |
| SCHEMBL9303004 | 0.78 | CHRM2 (0.50) | ALDH1A1TSHRCHRM2 | |
| SCHEMBL14624779 | 0.67 | ALDH1A1 (0.57) | ALDH1A1TSHRCHRM2POLB | |
| Hydrochloric Acid SCHEMBL29265123 | 0.66 | ALDH1A1 (0.44) | ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL29265104 | 0.65 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL319054 | 0.64 | — | — | |
| SCHEMBL14157308 | 0.64 | — | — | |
| SCHEMBL669513 | 0.64 | — | — | |
| SCHEMBL31498244 | 0.64 | HIF1A (0.49) | ALDH1A1TSHRPOLB | |
| SCHEMBL31498245 | 0.64 | HIF1A (0.49) | ALDH1A1TSHRPOLB |
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-118164932-A | Furanyl gemini quaternary ammonium salt compound, preparation method and application | 浙江糖能科技有限公司 | 2024-06-11 | — | — | CN | disclosed |