Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7026529 | 0.84 | MEN1 (0.41) | AOC3ALDH1A1MAPTHTT | |
| SCHEMBL8770924 | 0.84 | CES2 (0.39) | CYP2D6ADRB1HDAC3HDAC1HDAC2 | |
| SCHEMBL8770922 | 0.84 | AOC3 (0.42) | AOC3CYP2D6 | |
| SCHEMBL5922341 | 0.84 | FFAR1 (0.40) | ALDH1A1CYP2D6HDAC3HDAC1HDAC2 | |
| SCHEMBL8770939 | 0.84 | NPC1 (0.39) | CYP2D6CTSSCTSKHDAC3HDAC1 | |
| SCHEMBL5654433 | 0.83 | RIPK1 (0.51) | AOC3ALDH1A1MAPTCYP2D6CTSS | |
| SCHEMBL28857505 | 0.83 | RIPK1 (0.51) | AOC3ALDH1A1MAPTCYP2D6CTSS | |
| SCHEMBL8770874 | 0.83 | APP (0.42) | CYP2D6ADRB1ADRB3 | |
| SCHEMBL8770988 | 0.82 | CES2 (0.43) | MAPTCTSSCTSK | |
| SCHEMBL8770971 | 0.81 | HTT (0.59) | AOC3ALDH1A1MAPTHTTCYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0451668-B1 | Process for the production of optically active alkyl 3-aryl-3-hydroxypropionates | CHISSO CORP (JP) | 1997-08-13 | — | — | EP | disclosed |
| US-5202457-A | Enzyme catalyzed transesterification, resolution of optical active alkyl 3-aryl-3-hydroxypropionate | CHISSO CORPORATION (JP) | 1993-04-13 | — | — | US | disclosed |
| EP-0451668-A2 | Optically active alkyl 3-aryl-3-hydroxypropionates and a method for producing thereof | CHISSO CORPORATION (JP) | 1991-10-16 | — | — | EP | disclosed |