Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 4/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.31 |
| ▸ | SORT1 | Q99523 | 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 | |
|---|---|---|---|---|
| SCHEMBL5786004 | 0.75 | ALDH1A1 (0.37) | HRH4HRH3 | |
| SCHEMBL3286058 | 0.72 | BACE1 (0.36) | NOS3NOS1NOS2HRH3 | |
| SCHEMBL28518457 | 0.71 | NOS3 (0.37) | NOS3NOS1NOS2ESR1HRH4 | |
| Ammonia Solution, Strong SCHEMBL27564492 | 0.71 | HRH4 (0.40) | ESR1ESR2AAK1HRH4 | |
| SCHEMBL12775568 | 0.71 | HRH3 (0.37) | NOS3NOS1NOS2GPR84HRH3 | |
| SCHEMBL3840247 | 0.69 | HRH3 (0.42) | NOS2ESR1ESR2GPR84HRH3 | |
| Hydrochloric Acid SCHEMBL27869466 | 0.69 | KDM4E (0.37) | NOS3NOS1NOS2ESR1HRH4 | |
| Water SCHEMBL27918105 | 0.69 | NOS3 (0.36) | NOS3NOS1NOS2ESR1 | |
| SCHEMBL30443813 | 0.69 | SLC7A5 (0.41) | — | |
| SCHEMBL29022742 | 0.69 | SLC7A5 (0.41) | — |
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-109704626-A | The poly-carboxylic-acid cement grinding aid and preparation method thereof that Organic fluoride modifying glycol amine replaces | 湖南辰砾新材料有限公司 | 2019-05-03 | — | — | CN | claimed |