Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | UBE2N | P61088 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28107585 | 0.88 | MEN1 (0.48) | KMT2AMEN1CYP3A4PTGS1DRD3 | |
| SCHEMBL27606797 | 0.81 | CYP3A4 (0.50) | KMT2AMEN1CYP3A4PTGS1DRD3 | |
| SCHEMBL17111287 | 0.77 | MEN1 (0.45) | KMT2AMEN1CYP3A4PTGS1DRD3 | |
| SCHEMBL10158530 | 0.75 | CA9 (0.55) | KMT2AMEN1CYP3A4PTGS1DRD3 | |
| SCHEMBL31643742 | 0.75 | ALDH1A1 (0.50) | KMT2ACYP3A4CA9ALDH1A1KDM4E | |
| SCHEMBL3484657 | 0.75 | ALDH1A1 (0.50) | KMT2ACYP3A4CA9ALDH1A1KDM4E | |
| SCHEMBL5797963 | 0.75 | THRB (0.46) | KMT2AMEN1CYP3A4CA9ALDH1A1 | |
| SCHEMBL9720565 | 0.74 | ALDH1A1 (0.46) | KMT2AMEN1CYP3A4PTGS1DRD3 | |
| SCHEMBL16242748 | 0.74 | CYP3A4 (0.52) | KMT2AMEN1CYP3A4PTGS1DRD3 | |
| SCHEMBL9720603 | 0.73 | KMT2A (0.50) | KMT2AMEN1CYP3A4PTGS1DRD3 |
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 |