Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | TRPV4 | Q9HBA0 | 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 | |
|---|---|---|---|---|
| SCHEMBL29473362 | 0.88 | ALDH1A1 (0.39) | ALDH1A1HSD17B10TDP1TRPV4 | |
| SCHEMBL1162375 | 0.88 | ALDH1A1 (0.39) | ALDH1A1HSD17B10TDP1TRPV4 | |
| SCHEMBL29035044 | 0.84 | — | — | |
| SCHEMBL29035086 | 0.82 | ALDH1A1 (0.32) | ALDH1A1HSD17B10TDP1CYP1A2CYP2C19 | |
| SCHEMBL1162677 | 0.75 | ALDH1A1 (0.32) | ALDH1A1HSD17B10TDP1TRPV4 | |
| SCHEMBL1162497 | 0.73 | TRPV4 (0.36) | ALDH1A1HSD17B10TDP1TRPV4 | |
| SCHEMBL29473363 | 0.73 | TRPV4 (0.36) | ALDH1A1HSD17B10TDP1TRPV4 | |
| SCHEMBL10870565 | 0.72 | CTSB (0.33) | ALDH1A1HSD17B10TDP1TRPV4 | |
| SCHEMBL4446851 | 0.71 | CTSB (0.40) | ALDH1A1HSD17B10TDP1 | |
| SCHEMBL4455754 | 0.71 | CTSB (0.33) | ALDH1A1HSD17B10TDP1TRPV4 |
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-109154604-B | Charged surface reversed phase chromatography material method for analysis of glycans modified with amphiphilic strong basic moieties | 沃特世科技公司 | 2023-07-21 | — | — | CN | disclosed |