Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARA | P10276 | 2/20 | 0.54 |
| ▸ | RARB | P10826 | 2/20 | 0.54 |
| ▸ | RARG | P13631 | 2/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | ESR1 | P03372 | 2/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 4/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.45 |
| ▸ | JAK3 | P52333 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28928756 | 0.80 | ERN1 (0.44) | RARARARBRARGPTGS2ALDH1A1 | |
| SCHEMBL5029389 | 0.76 | MEN1 (0.55) | RARARARBRARGPTGS2ALDH1A1 | |
| SCHEMBL5519672 | 0.75 | PTGS2 (0.64) | PTGS2ALDH1A1HSD17B10CYP1A2CYP2C9 | |
| SCHEMBL5909547 | 0.75 | PTGS2 (0.64) | PTGS2ALDH1A1HSD17B10CYP1A2CYP2C9 | |
| SCHEMBL15149783 | 0.75 | TRPM8 (0.44) | ALDH1A1CYP1A2CYP2C9CYP2C19TRPM8 | |
| SCHEMBL27356584 | 0.75 | JAK2 (0.56) | RARARARBRARGPTGS2ALDH1A1 | |
| SCHEMBL31476860 | 0.75 | JAK2 (0.56) | RARARARBRARGPTGS2ALDH1A1 | |
| SCHEMBL28928759 | 0.74 | ESR1 (0.49) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL7907788 | 0.74 | TRPM8 (0.56) | RARARARBRARGESR1ESR2 | |
| SCHEMBL5909558 | 0.74 | PTGS2 (0.59) | PTGS2ALDH1A1HSD17B10TRPM8POLB |
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-109810073-B | 4-arylthiazole derivatives and pharmaceutical compositions thereof | 南京海辰药业股份有限公司 | 2023-01-06 | — | — | CN | disclosed |