Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Malonic Acid Diethyl Ester SCHEMBL7380431 | 0.96 | PPARG (0.36) | PPARGSMN1; SMN2PKMMKNK2ALDH1A1 | |
| SCHEMBL6058628 | 0.96 | PPARG (0.39) | PPARGSMN1; SMN2PKMMKNK2ALDH1A1 | |
| SCHEMBL6059446 | 0.86 | CPB2 (0.41) | PPARGSMN1; SMN2PKMMKNK2ALDH1A1 | |
| SCHEMBL6059053 | 0.85 | SMN1; SMN2 (0.36) | PPARGSMN1; SMN2PKMMKNK2ALDH1A1 | |
| SCHEMBL6058805 | 0.84 | PPARG (0.34) | PPARGMAPK1PPARA | |
| SCHEMBL6059174 | 0.82 | PPARG (0.34) | PPARGMKNK2AAK1LCKMAP4K4 | |
| Malonic Acid Diethyl Ester SCHEMBL7380709 | 0.82 | L3MBTL1 (0.41) | PPARGPKMMKNK2ALDH1A1L3MBTL1 | |
| SCHEMBL6059338 | 0.82 | LCK (0.40) | AAK1MAPK1LCKMAP4K4 | |
| SCHEMBL6060000 | 0.82 | CPB2 (0.39) | PPARGPKMMKNK2ALDH1A1TP53 | |
| SCHEMBL6059191 | 0.81 | MAP4K4 (0.35) | AAK1MAPK1LCKMAP4K4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7071175-B1 | Pyridine mercapto carboxylic acids as carboxypeptidase U inhibitors | ASTRAZENECA AB (SE) | 2006-07-04 | — | — | US | disclosed |
| EP-1180098-A1 | NEW COMPOUNDS | AstraZeneca AB (SE) | 2002-02-20 | — | — | EP | disclosed |
| WO-2000066557-A1 | NEW COMPOUNDS | ASTRAZENECA AB (SE) | 2000-11-09 | — | — | WO | disclosed |