Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1577845 | 1.00 | ALDH1A1 (0.31) | ALDH1A1MAOAMAOB | |
| SCHEMBL31549866 | 0.96 | ALDH1A1 (0.33) | ALDH1A1 | |
| Chloromethane SCHEMBL27672310 | 0.94 | — | — | |
| Methylamine SCHEMBL27332531 | 0.94 | MAOA (0.32) | MAOAMAOB | |
| SCHEMBL6496501 | 0.82 | MAOB (0.33) | MAOAMAOB | |
| SCHEMBL746905 | 0.81 | — | — | |
| SCHEMBL27496143 | 0.81 | — | — | |
| SCHEMBL7422830 | 0.81 | — | — | |
| SCHEMBL27880139 | 0.81 | — | — | |
| SCHEMBL27602565 | 0.80 | — | — |
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-102492132-A | Polyaryletherketone copolymers containing cyano group and preparation method for polyaryletherketone copolymers | CHINA RUBBER GROUP CARBON BLACK RES & DESIGN INST | 2012-06-13 | — | — | CN | disclosed |