Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL9425290 | 0.98 | TRPV1 (0.33) | HTR1ADRD2HTR2AHTR7TRPV1 | |
| SCHEMBL9425488 | 0.83 | HTR1A (0.39) | HTR1ADRD2HTR2AHTR7MAPK1 | |
| SCHEMBL20250954 | 0.74 | HTR1A (0.48) | HTR1ADRD2HTR2AHTR7 | |
| SCHEMBL10396554 | 0.74 | HTR1A (0.48) | HTR1ADRD2HTR2AHTR7 | |
| SCHEMBL10396090 | 0.74 | HTR1A (0.48) | HTR1ADRD2HTR2AHTR7 | |
| SCHEMBL2155981 | 0.74 | TSHR (0.47) | TRPV1TRPA1ALDH1A1MAPT | |
| SCHEMBL28576041 | 0.74 | TSHR (0.47) | TRPV1TRPA1ALDH1A1MAPT | |
| SCHEMBL28576200 | 0.74 | TSHR (0.47) | TRPV1TRPA1ALDH1A1MAPT | |
| SCHEMBL13619244 | 0.74 | TSHR (0.47) | TRPV1TRPA1ALDH1A1MAPT | |
| SCHEMBL29093179 | 0.74 | TSHR (0.47) | TRPV1TRPA1ALDH1A1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0594621-A1 | PROCESS FOR ENZYMATICALLY PREPARING ENANTIOMER-FREE ESTERS AND ALCOHOLS | Roche Diagnostics GmbH (DE) | 1994-05-04 | — | — | EP | disclosed |
| WO-1993002034-A1 | PROCESS FOR ENZYMATICALLY PREPARING ENANTIOMER-FREE ESTERS AND ALCOHOLS | BOEHRINGER MANNHEIM GMBH (DE) | 1993-02-04 | — | — | WO | disclosed |