Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MGAM | O43451 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | SI | P14410 | 2/20 | 0.35 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Ethoxycarbonyl Group SCHEMBL9528444 | 0.87 | — | — | |
| Ethoxycarbonyl Group SCHEMBL4631753 | 0.84 | — | — | |
| Ethyl Acetate SCHEMBL6324518 | 0.83 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Butanone SCHEMBL28264185 | 0.82 | ALDH1A1 (0.53) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethoxycarbonyl Group SCHEMBL27662161 | 0.82 | ALDH1A1 (0.38) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethoxycarbonyl Group SCHEMBL7400598 | 0.81 | — | — | |
| Propylformate SCHEMBL11211707 | 0.81 | ALDH1A1 (0.46) | ALDH1A1LMNAHSD17B10MGAMGAA | |
| Ethoxycarbonyl Group SCHEMBL18076005 | 0.81 | — | — | |
| Ethoxycarbonyl Group SCHEMBL3225173 | 0.81 | — | — | |
| Ethoxycarbonyl Group SCHEMBL453 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1356548-A | Gas-phase chromatographic capillary column for monitoring spirit quality and its preparing process and application | DALIAN CHEMICAL PHYSICS INST (CN) | 2002-07-03 | — | — | CN | disclosed |
| US-5603835-A | SEPARATION OF COLOR-CAUSING IMPURITIES BY SOLVENT EXTRACTION WITH ESTERS AND/OR ETHERS; PURIFICATION, DECOLORING | HOECHST CELANESE CORPORATION (US) | 1997-02-18 | — | — | US | disclosed |
| US-5256259-A | Separation of hexane from vinyl acetate by azeotropic distillation | Berg, Lloyd (US) | 1993-10-26 | — | — | US | disclosed |