Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 7/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | BLM | P54132 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | GMNN | O75496 | 1/20 | 0.46 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL15339370 | 0.93 | GAA (0.51) | GAAKMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL208761 | 0.90 | GAA (0.60) | GAAKMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL858494 | 0.90 | GAA (0.60) | GAAKMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL17584989 | 0.89 | GAA (0.56) | GAAKMT2AMEN1ALDH1A1TSHR | |
| Ethane SCHEMBL9814026 | 0.89 | GAA (0.59) | GAAKMT2AMEN1ALDH1A1TSHR | |
| Methane SCHEMBL5968168 | 0.89 | GAA (0.59) | GAAKMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL887482 | 0.88 | GAA (0.55) | GAAKMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL13302847 | 0.88 | GAA (0.57) | GAAKMT2AMEN1ALDH1A1TSHR | |
| Ethylene SCHEMBL4038426 | 0.88 | GAA (0.57) | GAAKMT2AMEN1ALDH1A1TSHR | |
| Ethylene SCHEMBL6909288 | 0.88 | GAA (0.57) | GAAKMT2AMEN1ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-20200339727-A1 | ANTIOXIDANT FOR LOW-DENSITY POLYURETHANE FOAM | SHELL OIL COMPANY | 2020-10-29 | — | — | US | disclosed |