Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HPGDS | O60760 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | STAT6 | P42226 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9576976 | 0.97 | HMGCR (0.47) | HMGCRADRA1AMTNR1AMTNR1BALDH1A1 | |
| SCHEMBL12567492 | 0.85 | ADRA1A (0.41) | ADRA1AMTNR1AMTNR1BALDH1A1MEN1 | |
| SCHEMBL9576702 | 0.84 | ALDH1A1 (0.47) | HMGCRADRA1AMTNR1AMTNR1BALDH1A1 | |
| SCHEMBL12565602 | 0.83 | ALDH1A1 (0.50) | ADRA1AMTNR1AMTNR1BALDH1A1TDP1 | |
| SCHEMBL17874456 | 0.83 | DPP4 (0.47) | MTNR1AMTNR1BALDH1A1MEN1KMT2A | |
| SCHEMBL12918718 | 0.80 | HTT (0.52) | ALDH1A1MEN1KMT2APOLBRXRA | |
| SCHEMBL3427457 | 0.79 | ALDH1A1 (0.50) | ADRA1AALDH1A1TDP1L3MBTL1CYP3A4 | |
| SCHEMBL3424668 | 0.79 | MAPT (0.50) | ADRA1AALDH1A1TDP1RXRARXRB | |
| SCHEMBL833885 | 0.78 | ADRA1A (0.59) | ADRA1AALDH1A1CA9KDM4EGLA | |
| SCHEMBL9720538 | 0.77 | ALDH1A1 (0.41) | ADRA1AALDH1A1MEN1KMT2ARXRA |
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 |
|---|---|---|---|---|---|---|---|
| US-5103022-A | Reacting dl-2-methyl-1-(4-trifluoromethylphenyl)-3-pyrrolidino -1-propanone with l-acetylphenylglycine to form corresponding diastereomeric salt, deposition, isolation of l-2-methyl-1-(4-trifluoromethylphenyl)-3-pyrrolidino-1-propanone | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1992-04-07 | — | — | US | disclosed |
| US-5057535-A | Muscle relaxants | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1991-10-15 | — | — | US | disclosed |
| EP-0200942-A2 | New derivatives of an aminoketone | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1986-11-12 | — | — | EP | disclosed |