Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPA1 | P15085 | 6/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.48 |
| ▸ | CPA3 | P15088 | 3/20 | 0.44 |
| ▸ | CPB2 | Q96IY4 | 2/20 | 0.44 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.44 |
| ▸ | CPB1 | P15086 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | ALPI | P09923 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | XIAP | P98170 | 1/20 | 0.42 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1127361 | 0.82 | CYP1A2 (0.53) | CPA1CYP1A2P4HTMCPA3CPB2 | |
| SCHEMBL1888804 | 0.79 | CPA1 (0.53) | CPA1CYP1A2P4HTMCPA3CPB2 | |
| SCHEMBL28092231 | 0.79 | L3MBTL1 (0.41) | CPA1CYP1A2CPA3CPB2CPB1 | |
| SCHEMBL17825462 | 0.75 | P4HTM (0.54) | CPA1CYP1A2P4HTMCPA3CPB2 | |
| SCHEMBL17479494 | 0.74 | P4HTM (0.50) | CPA1CYP1A2P4HTMCPA3CPB2 | |
| SCHEMBL7816162 | 0.73 | CHRM1 (0.61) | CPA1CYP1A2P4HTMEPHX1SLC6A2 | |
| SCHEMBL7816160 | 0.73 | CHRM1 (0.61) | CPA1CYP1A2P4HTMEPHX1SLC6A2 | |
| SCHEMBL7346172 | 0.73 | CYP1A2 (0.77) | CPA1CYP1A2CPA3CPB2FOLH1 | |
| SCHEMBL11643934 | 0.73 | P2RX7 (0.38) | CYP1A2PKMALDH1A1CYP3A4 | |
| SCHEMBL1127590 | 0.73 | KMT2A (0.46) | CYP1A2P4HTMSLC6A2SLC6A4SLC6A3 |
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 |