Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A3 | P43003 | 3/20 | 0.38 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.38 |
| ▸ | SLC1A1 | P43005 | 3/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.32 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.31 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | GCLC | P48506 | 2/20 | 0.31 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.31 |
| ▸ | GRIK3 | Q13003 | 1/20 | 0.31 |
| ▸ | GRIK5 | Q16478 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | HRH1 | P35367 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3823055 | 0.81 | MAPT (0.41) | SLC1A3SLC1A2SLC1A1SLC7A5CHRM1 | |
| Hydrochloric Acid SCHEMBL1439109 | 0.79 | MAPT (0.41) | SLC1A3SLC1A2SLC1A1SLC7A5CHRM1 | |
| SCHEMBL12582818 | 0.75 | ALOX15 (0.46) | SLC1A3SLC1A2SLC1A1SLC7A5GRIK1 | |
| SCHEMBL15083214 | 0.75 | ALOX15 (0.46) | SLC1A3SLC1A2SLC1A1SLC7A5GRIK1 | |
| SCHEMBL4405650 | 0.75 | ALOX15 (0.46) | SLC1A3SLC1A2SLC1A1SLC7A5GRIK1 | |
| SCHEMBL2566927 | 0.74 | ALDH1A1 (0.35) | SLC1A3SLC1A2SLC1A1ALOX15CA2 | |
| SCHEMBL2110683 | 0.74 | TSHR (0.35) | SLC1A3SLC1A2SLC1A1ALOX15CA2 | |
| Hydrochloric Acid SCHEMBL1437174 | 0.73 | ALOX15 (0.44) | SLC1A3SLC1A2SLC1A1SLC7A5GRIK1 | |
| SCHEMBL11473960 | 0.72 | — | — | |
| SCHEMBL6848203 | 0.72 | — | — |
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-115594631-A | Rosemastat key intermediate and preparation method of Rosemastat intermediate | 安徽省庆云医药股份有限公司（CN） | 2023-01-13 | — | — | CN | disclosed |