Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ESRRG | P62508 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7539309 | 0.91 | ELANE (0.30) | — | |
| SCHEMBL130243 | 0.85 | ALDH1A1 (0.44) | TSHRALDH1A1CYP3A4 | |
| SCHEMBL8655739 | 0.79 | HTR2A (0.31) | — | |
| SCHEMBL8959927 | 0.77 | TSHR (0.55) | TSHRESRRGALDH1A1CYP3A4NR1H2 | |
| SCHEMBL14949883 | 0.76 | ALDH1A1 (0.37) | TSHRALDH1A1CYP3A4NR1H2NR1H3 | |
| SCHEMBL3709630 | 0.76 | TSHR (0.34) | TSHRALDH1A1CYP3A4NR1H2NR1H3 | |
| SCHEMBL27658222 | 0.75 | TSHR (0.68) | TSHRESRRGALDH1A1NR1H2NR1H3 | |
| SCHEMBL27587413 | 0.75 | TSHR (0.33) | TSHRALDH1A1CYP3A4 | |
| SCHEMBL131242 | 0.74 | CNR2 (0.31) | TSHR | |
| SCHEMBL28860546 | 0.73 | CNR2 (0.39) | ALDH1A1 |
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-5202485-A | Catalytic reductive alkylation of aminophenol using aldehyde or ketone | SUMITOMO CHEMICAL CO., LTD. (JP) | 1993-04-13 | — | — | US | disclosed |