Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 5/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 5/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | GLS | O94925 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28608905 | 0.84 | CTBP2 (0.44) | PTGESMAPK8GLS | |
| SCHEMBL28623769 | 0.83 | PIK3CA (0.45) | — | |
| SCHEMBL28607997 | 0.83 | ANPEP (0.40) | MAOBGLS | |
| SCHEMBL28605788 | 0.82 | TSHR (0.45) | — | |
| SCHEMBL28605790 | 0.81 | CTBP2 (0.48) | — | |
| SCHEMBL28609788 | 0.78 | L3MBTL1 (0.44) | MAPK8 | |
| SCHEMBL28920257 | 0.75 | HPGD (0.44) | — | |
| SCHEMBL28604758 | 0.74 | HTT (0.44) | — | |
| SCHEMBL21649896 | 0.72 | PTGES (0.48) | PTGESEGFRERBB2MAOBRIPK1 | |
| SCHEMBL28610799 | 0.71 | HTT (0.47) | — |
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-109942612-B | Diyne enamine compound and preparation method and application thereof | 北京大学深圳研究生院 | 2021-08-20 | — | — | CN | disclosed |