Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9332613 | 0.94 | GAA (0.53) | AMY1ACYP2C9CYP2C19HIF1ASMN1; SMN2 | |
| SCHEMBL331989 | 0.84 | GAA (0.53) | AMY1AGAAHSPA5GABRA1GABRB2 | |
| SCHEMBL10356525 | 0.83 | DHFR (0.51) | AMY1ACYP2C9CYP2C19HIF1ASMN1; SMN2 | |
| SCHEMBL15758050 | 0.81 | GAA (0.43) | AMY1AGAAHSPA5GABRA1GABRB2 | |
| SCHEMBL4219327 | 0.81 | GAA (0.43) | GAAHSD17B10GABRA1GABRB2KDM4E | |
| SCHEMBL5462999 | 0.78 | HSPA5 (0.66) | CYP2C9CYP2C19HIF1ASMN1; SMN2GAA | |
| SCHEMBL333788 | 0.78 | MEN1 (0.50) | GAAGABRA1GABRB2KDM4EMEN1 | |
| SCHEMBL5882352 | 0.78 | ERN1 (0.60) | GAAGABRA1GABRB2KDM4EESR1 | |
| SCHEMBL9489328 | 0.77 | DHFR (0.48) | GAAGABRA1GABRB2KDM4EMEN1 | |
| SCHEMBL9945781 | 0.77 | SHBG (0.51) | GAAGABRA1GABRB2KDM4EESR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1311604-B1 | ANTIOXIDANT AGENT BASED ON PHENOLIC SALTS | LANXESS DEUTSCHLAND GMBH (DE) | 2005-11-02 | — | — | EP | disclosed |
| EP-1311604-A1 | ANTIOXIDANT AGENT BASED ON PHENOLIC SALTS | Bayer Aktiengesellschaft (DE) | 2003-05-21 | — | — | EP | disclosed |
| WO-2002014419-A1 | ANTIOXIDANT AGENT BASED ON PHENOLIC SALTS | BAYER AKTIENGESELLSCHAFT (DE) | 2002-02-21 | — | — | WO | disclosed |