Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12489191 | 0.84 | TRPA1 (0.39) | TSHRTRPA1 | |
| SCHEMBL2467052 | 0.82 | PTGS1 (0.40) | TSHRPTGS1KCNH2TRPA1 | |
| Ethylene Glycol SCHEMBL28152293 | 0.80 | TRPA1 (0.42) | TSHRPTGS1KCNH2TRPA1 | |
| Ethylene Glycol SCHEMBL2832859 | 0.80 | TRPA1 (0.42) | TSHRPTGS1KCNH2TRPA1 | |
| SCHEMBL17072023 | 0.79 | TRPA1 (0.45) | TSHRPTGS1KCNH2TRPA1 | |
| SCHEMBL20721697 | 0.79 | TRPA1 (0.45) | TSHRPTGS1KCNH2TRPA1 | |
| SCHEMBL19645 | 0.79 | TRPA1 (0.45) | TSHRPTGS1KCNH2TRPA1 | |
| Isobutanol SCHEMBL6152369 | 0.78 | TSHR (0.45) | TSHRPTGS1KCNH2TRPA1 | |
| SCHEMBL10818718 | 0.77 | TRPA1 (0.43) | TSHRPTGS1KCNH2TRPA1 | |
| SCHEMBL28284516 | 0.77 | TRPA1 (0.35) | PTGS1KCNH2TRPA1 |
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-105793310-A | Polyesters and coatings containing the same | PPG工业俄亥俄公司 | 2016-07-20 | — | — | CN | disclosed |