Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 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 | |
|---|---|---|---|---|
| SCHEMBL28249886 | 0.73 | GABRA1 (0.38) | — | |
| SCHEMBL28514779 | 0.69 | NOS3 (0.31) | MAPK1HTTNOS3NOS1 | |
| SCHEMBL28744331 | 0.66 | NOS3 (0.31) | NOS3NOS1 | |
| SCHEMBL7939604 | 0.59 | — | — | |
| SCHEMBL4403128 | 0.58 | MAPK1 (0.41) | MAPK1HTTNOS3NOS1 | |
| SCHEMBL20198311 | 0.57 | MAPK1 (0.41) | MAPK1HTTNOS3NOS1 | |
| SCHEMBL11727995 | 0.57 | — | — | |
| SCHEMBL20088851 | 0.57 | ALDH1A1 (0.38) | MAPK1HTTNOS3NOS1 | |
| SCHEMBL755432 | 0.56 | ALDH1A1 (0.47) | MAPK1HTTNOS3NOS1 | |
| SCHEMBL20198346 | 0.55 | ALOX12 (0.43) | MAPK1HTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108727422-B | Six-membered nitrogen oxygen silicon heterocyclic compound and preparation method thereof | 中国石油天然气股份有限公司 | 2021-01-01 | — | — | CN | claimed |
| CN-108727422-B | Six-membered nitrogen oxygen silicon heterocyclic compound and preparation method thereof | 中国石油天然气股份有限公司 | 2021-01-01 | — | — | CN | disclosed |
| CN-108727422-A | Six-membered nitrogen oxygen silicon heterocyclic compound and preparation method thereof | 中国石油天然气股份有限公司 | 2018-11-02 | — | — | CN | disclosed |