Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28036323 | 0.89 | CYP2C19 (0.52) | CYP2C9CYP2C19HTTKMT2AKDM4E | |
| SCHEMBL8770955 | 0.89 | CYP2C19 (0.52) | CYP2C9CYP2C19HTTKMT2AKDM4E | |
| SCHEMBL8770898 | 0.86 | NLRP3 (0.41) | CYP2C9CYP2C19MAPTTSHRF2 | |
| SCHEMBL8770959 | 0.85 | KMT2A (0.37) | CYP2C9CYP2C19HTTKMT2ARAB9A | |
| SCHEMBL8770951 | 0.81 | CYP26A1 (0.36) | CYP2C9CYP2C19HTTTSHR | |
| SCHEMBL12383448 | 0.79 | TAAR1 (0.33) | CYP2C9CYP2C19PPARGPOLB | |
| SCHEMBL8770909 | 0.77 | HTT (0.51) | HTTRAB9APPARGPOLB | |
| SCHEMBL28754169 | 0.76 | CYP2C19 (0.48) | CYP2C9CYP2C19HTTKMT2AKDM4E | |
| SCHEMBL8770910 | 0.76 | CES2 (0.46) | HTTKMT2AMAPTMEN1 | |
| SCHEMBL8770882 | 0.76 | MEN1 (0.44) | KMT2AMAPTRAB9AMEN1 |
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 |