Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ACE | P12821 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16467209 | 0.81 | CYP19A1 (0.43) | EPHX1MEN1HTTKMT2AKDM4E | |
| SCHEMBL16467167 | 0.79 | CYP19A1 (0.45) | ALDH1A1EPHX1HTTKDM4ENAAA | |
| SCHEMBL14759200 | 0.79 | EPHX1 (0.33) | EPHX1MEN1HTTKMT2AKDM4E | |
| SCHEMBL10958425 | 0.79 | GABRR1 (0.39) | EPHX1GABRR1CYP1A2NAAA | |
| SCHEMBL14759131 | 0.78 | EPHX1 (0.35) | ALDH1A1EPHX1KDM4ENAAA | |
| SCHEMBL878503 | 0.77 | TSHR (0.37) | ALDH1A1EPHX1MEN1HTTKMT2A | |
| Bicarbonate SCHEMBL6550780 | 0.77 | EPHX1 (0.37) | ALDH1A1EPHX1CYP1A2KDM4ENAAA | |
| SCHEMBL721104 | 0.77 | SLC1A3 (0.44) | ALDH1A1EPHX1KDM4E | |
| SCHEMBL14759119 | 0.77 | EPHX1 (0.34) | ALDH1A1EPHX1MEN1HTTKMT2A | |
| SCHEMBL25356880 | 0.76 | GRIK1 (0.42) | ALDH1A1PTGS1CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104203905-A | Process for producing beta-alkoxypropionamide | IDEMITSU KOSAN CO | 2014-12-10 | — | — | CN | disclosed |