Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 2/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.44 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8770900 | 0.88 | ADRA1A (0.65) | ADRA1AADRA2ALMNACYP1A2TSHR | |
| SCHEMBL8770911 | 0.87 | ADRA1A (0.46) | ADRA1AADRA2ALMNACYP1A2TSHR | |
| SCHEMBL8770899 | 0.86 | ADRA1A (0.50) | ADRA1AADRA2ALMNACYP1A2TSHR | |
| SCHEMBL8770941 | 0.86 | ADRA1A (0.44) | ADRA1AADRA2ALMNACYP1A2TSHR | |
| SCHEMBL8770909 | 0.81 | HTT (0.51) | — | |
| SCHEMBL2975604 | 0.80 | ADRA1A (0.57) | ADRA1AADRA2ALMNACYP1A2TSHR | |
| SCHEMBL29684720 | 0.80 | ADRA1A (0.57) | ADRA1AADRA2ALMNACYP1A2TSHR | |
| SCHEMBL7153263 | 0.79 | ADRA1A (0.75) | ADRA1AADRA2ALMNACYP1A2TSHR | |
| SCHEMBL9173075 | 0.79 | ADRA2A (0.56) | ADRA1AADRA2AADRB2ADRB1ADRB3 | |
| SCHEMBL8121642 | 0.77 | HDAC3 (0.45) | ALDH1A1TAS1R3TAS1R1 |
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 |