Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL88417 | 0.91 | AOC3 (0.54) | AOC3CA12CA1CA2CA7 | |
| SCHEMBL16371575 | 0.91 | AOC3 (0.54) | AOC3CA12CA1CA2CA7 | |
| Ethylene SCHEMBL173233 | 0.89 | AOC3 (0.52) | AOC3CA12CA1CA2CA7 | |
| Hydrogen Sulfide SCHEMBL5394729 | 0.89 | AOC3 (0.52) | AOC3CA12CA1CA2CA7 | |
| SCHEMBL28143139 | 0.89 | AOC3 (0.52) | AOC3CA12CA1CA2CA7 | |
| Water SCHEMBL1169336 | 0.89 | AOC3 (0.52) | AOC3CA12CA1CA2CA7 | |
| SCHEMBL3730541 | 0.89 | AOC3 (0.52) | AOC3CA12CA1CA2CA7 | |
| SCHEMBL31591236 | 0.89 | CA12 (0.55) | AOC3CA12CA1CA2CA7 | |
| SCHEMBL3744653 | 0.89 | CA12 (0.55) | AOC3CA12CA1CA2CA7 | |
| SCHEMBL28204668 | 0.89 | AOC3 (0.52) | AOC3CA12CA1CA2CA7 |
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-109370131-B | Dynamic topological interlocking dual network and preparation method and application thereof | 中山大学 | 2021-01-22 | — | — | CN | disclosed |