Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | GNAO1 | P09471 | 4/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | LSS | P48449 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.38 |
| ▸ | DRD4 | P21917 | 2/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | GNAI3 | P08754 | 3/20 | 0.36 |
| ▸ | GNAI1 | P63096 | 3/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL30330505 | 0.98 | GNAO1 (0.44) | CYP1A2GNAO1HRH3LSSCHRM1 | |
| Fluoride SCHEMBL30331257 | 0.98 | CYP1A2 (0.43) | CYP1A2GNAO1HRH3LSSCHRM1 | |
| SCHEMBL12558281 | 0.94 | LSS (0.44) | CYP1A2GNAO1HRH3LSSCHRM1 | |
| Acetic Acid SCHEMBL30212792 | 0.89 | MAPT (0.42) | CYP1A2GNAO1HRH3LSSCHRM1 | |
| SCHEMBL12561561 | 0.88 | CYP1A2 (0.52) | CYP1A2LSS | |
| SCHEMBL29252374 | 0.88 | GNAO1 (0.38) | CYP1A2GNAO1HRH3LSSCHRM1 | |
| SCHEMBL16154793 | 0.87 | HRH3 (0.37) | GNAO1HRH3CHRM1CHRM2CHRM4 | |
| SCHEMBL12112146 | 0.87 | CYP1A2 (0.54) | CYP1A2GNAO1HRH3CHRM1CHRM2 | |
| Hydrochloric Acid SCHEMBL30330784 | 0.86 | CYP1A2 (0.50) | CYP1A2GNAO1LSS | |
| Fluoride SCHEMBL30331072 | 0.85 | CYP1A2 (0.52) | CYP1A2GNAO1HRH3CHRM1CHRM2 |
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-113646081-B | Mesoporous catalyst compounds and uses thereof | 埃克森美孚科技工程公司 | 2024-01-09 | — | — | CN | disclosed |