Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 2/20 | 0.43 |
| ▸ | CES1 | P23141 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Propionic Acid SCHEMBL7092961 | 0.84 | FFAR3 (0.43) | FFAR3CES2CES1GLAALDH1A1 | |
| Methyl Alcohol SCHEMBL28358130 | 0.83 | CA2 (0.38) | CES2CES1GLAALDH1A1TSHR | |
| SCHEMBL1667 | 0.80 | ALDH1A1 (0.35) | CES2CES1GLAALDH1A1TSHR | |
| SCHEMBL13583073 | 0.80 | ALDH1A1 (0.35) | CES2CES1GLAALDH1A1TSHR | |
| Ethylene Glycol SCHEMBL28318109 | 0.78 | TDP1 (0.40) | CES2CES1GLAALDH1A1TSHR | |
| SCHEMBL30171495 | 0.77 | ALDH1A1 (0.33) | CES2CES1GLAALDH1A1TSHR | |
| SCHEMBL20338478 | 0.77 | ALDH1A1 (0.33) | CES2CES1GLAALDH1A1TSHR | |
| SCHEMBL28598523 | 0.77 | ALDH1A1 (0.33) | CES2CES1GLAALDH1A1TSHR | |
| SCHEMBL821938 | 0.77 | ALDH1A1 (0.33) | CES2CES1GLAALDH1A1TSHR | |
| SCHEMBL28339876 | 0.77 | ALDH1A1 (0.33) | CES2CES1GLAALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-115058185-A | Flame-retardant waterborne polyurethane paint and synthesis method thereof | 薛庆霞 | 2022-09-16 | — | — | CN | disclosed |