Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | EDNRB | P24530 | 1/20 | 0.42 |
| ▸ | EDNRA | P25101 | 1/20 | 0.42 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL1670311 | 1.00 | CYP2C19 (0.46) | CYP2C19HIF1ACYP2D6CYP3A4CYP1A2 | |
| SCHEMBL5041181 | 0.90 | CYP2C9 (0.49) | LMNAMAPTPPARGPPARAALDH1A1 | |
| SCHEMBL5041186 | 0.90 | CYP2C9 (0.49) | LMNAMAPTPPARGPPARAALDH1A1 | |
| SCHEMBL4298978 | 0.87 | LMNA (0.46) | CYP2C19HIF1ACYP2D6CYP3A4CYP1A2 | |
| SCHEMBL6055984 | 0.85 | ESR1 (0.50) | CYP3A4LMNAALDH1A1CHRM2CHRM4 | |
| SCHEMBL6061648 | 0.85 | ESR1 (0.50) | CYP3A4LMNAALDH1A1CHRM2CHRM4 | |
| SCHEMBL3702043 | 0.85 | PPARG (0.46) | CYP2C19HIF1ACYP2D6CYP3A4CYP1A2 | |
| SCHEMBL13148475 | 0.84 | CES1 (0.50) | CYP2C19HIF1ACYP2D6CYP3A4CYP1A2 | |
| SCHEMBL7861200 | 0.84 | PIN1 (0.50) | CYP2C19HIF1ACYP2D6CYP3A4CYP1A2 | |
| SCHEMBL1678855 | 0.84 | NPC1 (0.41) | CYP2C19CYP3A4CYP1A2LMNAKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1404309-A1 | A PHARMACEUTICAL COMBINATION COMPRISING EITHER (S)-2-ETHOXY-3- 4-(2- 4-METHANE SULFONYL OXYPHENYL ETHOXY) PHENYL] PROPANOIC ACID OR 3- 4- 2- (4-TERT-BUTOXY CARBONYL AMINOPHENYL) ETHOXY] PHENYL -(S)-2-ETHOXY PROPANOIC ACID AND A BIGUANIDE DRUG | AstraZeneca AB (SE) | 2004-04-07 | — | — | EP | disclosed |
| EP-1401485-A1 | A PHARMACEUTICAL COMBINATION COMPRISING EITHER (S)-2-ETHOXY-3 4-(2- 4-METHANE SULFONYL OXYPHENYL ETHOXY)PHENYL] PROPANOIC ACID OR 3- 4- 2- (4-TERT-BUTOXY CARBONYLAMINO PHENYL) ETHOXY] PHENYL -(S)-2-ETHOXY PROPANOIC ACID AND INSULIN | AstraZeneca AB (SE) | 2004-03-31 | — | — | EP | disclosed |