Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 2/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 3/20 | 0.38 |
| ▸ | ORAI1 | Q96D31 | 2/20 | 0.38 |
| ▸ | ORAI2 | Q96SN7 | 2/20 | 0.38 |
| ▸ | ORAI3 | Q9BRQ5 | 2/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.38 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | BAX | Q07812 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28102434 | 0.95 | CA1 (0.46) | CA4CA1CA2LTA4HTSHR | |
| SCHEMBL28337059 | 0.95 | CA1 (0.46) | CA4CA1CA2LTA4HTSHR | |
| SCHEMBL78440 | 0.95 | CA1 (0.46) | CA4CA1CA2LTA4HTSHR | |
| Benzene SCHEMBL28134938 | 0.95 | CA1 (0.46) | CA4CA1CA2LTA4HTSHR | |
| SCHEMBL28682844 | 0.92 | CA4 (0.42) | CA4CA1CA2LTA4HTSHR | |
| SCHEMBL187418 | 0.92 | CA1 (0.44) | CA4CA1CA2LTA4HTSHR | |
| Fluoride SCHEMBL5138060 | 0.92 | CA1 (0.44) | CA4CA1CA2LTA4HTSHR | |
| Ammonia Solution, Strong SCHEMBL4965987 | 0.92 | CA1 (0.44) | CA4CA1CA2LTA4HTSHR | |
| SCHEMBL139425 | 0.92 | CA1 (0.44) | CA4CA1CA2LTA4HTSHR | |
| SCHEMBL31488700 | 0.92 | CA1 (0.44) | CA4CA1CA2LTA4HTSHR |
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-106442459-A | Gold-based extraction material functionalized by different affinity ligands, and application thereof in surface Plasmon optical affinity sandwich analysis | 南京大学 | 2017-02-22 | — | — | CN | disclosed |