Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 6/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL26127707 | 0.85 | ALDH1A1 (0.50) | ALDH1A1TSHRTP53HSD17B10 | |
| SCHEMBL36299 | 0.85 | — | — | |
| Acrylic Acid Methyl Ester SCHEMBL27571924 | 0.84 | HSD17B10 (0.45) | ALDH1A1TSHRHCAR2KEAP1NFE2L2 | |
| Acrylic Acid Methyl Ester SCHEMBL17979227 | 0.84 | TSHR (0.38) | ALDH1A1TSHRHCAR2KEAP1NFE2L2 | |
| Acrylic Acid Methyl Ester SCHEMBL28083209 | 0.82 | ALDH1A1 (0.37) | ALDH1A1TSHRHCAR2KEAP1NFE2L2 | |
| Acrylic Acid Methyl Ester SCHEMBL27473540 | 0.79 | TSHR (0.43) | ALDH1A1TSHRHCAR2KEAP1NFE2L2 | |
| Acrylic Acid Methyl Ester SCHEMBL302020 | 0.78 | TSHR (0.52) | ALDH1A1TSHRHCAR2KEAP1NFE2L2 | |
| Acrylic Acid Methyl Ester SCHEMBL27662771 | 0.78 | TSHR (0.52) | ALDH1A1TSHRHCAR2KEAP1NFE2L2 | |
| Acrylic Acid Methyl Ester SCHEMBL28112669 | 0.78 | — | — | |
| Acrylic Acid Methyl Ester SCHEMBL6060989 | 0.78 | — | — |
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-108368335-A | Polyurethane-based curable composition containing polymer microparticles and having excellent mechanical strength | 株式会社钟化 | 2018-08-03 | — | — | CN | disclosed |