Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 1/20 | 0.41 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.41 |
| ▸ | CTSA | P10619 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | HMOX2 | P30519 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28788265 | 0.83 | ALDH1A1 (0.43) | CASP1LMNACYP2C19ALDH1A1CYP3A4 | |
| SCHEMBL1131686 | 0.81 | ALDH1A1 (0.55) | GABBR2GABBR1FFAR1EPHX2CASP1 | |
| SCHEMBL170301 | 0.79 | SLC6A2 (0.55) | GABBR2GABBR1FFAR1EPHX2LMNA | |
| SCHEMBL1888807 | 0.78 | GABBR2 (0.44) | GABBR2GABBR1CTSAFFAR1LMNA | |
| SCHEMBL22408433 | 0.78 | AHR (0.37) | CTSAFFAR1ALDH1A1TSHRKDM4E | |
| Hydrochloric Acid SCHEMBL128794 | 0.78 | SLC6A2 (0.53) | GABBR2GABBR1FFAR1EPHX2LMNA | |
| SCHEMBL16150460 | 0.77 | P2RX7 (0.42) | GABBR2GABBR1PTGDR2CYP2C19CYP3A4 | |
| SCHEMBL28092231 | 0.77 | L3MBTL1 (0.41) | PTGDR2CYP2C19ALDH1A1TSHRKDM4E | |
| SCHEMBL21643045 | 0.76 | CTSA (0.52) | CTSA | |
| SCHEMBL4557709 | 0.74 | ALDH1A1 (0.44) | LMNASLC6A2SLC6A4SLC6A3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2091940-B3 | 4-PHENYL-6-(2,2,2-TRIFLUORO-1-PHENYLETHOXY)PYRIMIDINE-BASED COMPOUNDS AND METHODS OF THEIR USE | LEXICON PHARMACEUTICALS INC (US) | 2017-12-06 | — | — | EP | disclosed |