Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.56 |
| ▸ | CA1 | P00915 | 4/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Benzyl Alcohol SCHEMBL7783453 | 0.85 | TSHR (0.70) | TSHRCA1CA2CA7CA9 | |
| SCHEMBL508126 | 0.84 | CA1 (0.70) | TSHRCA1CA2CA7CA9 | |
| SCHEMBL122306 | 0.84 | CA1 (0.70) | TSHRCA1CA2CA7CA9 | |
| SCHEMBL218661 | 0.84 | CA1 (0.70) | TSHRCA1CA2CA7CA9 | |
| SCHEMBL16269805 | 0.84 | CA1 (0.70) | TSHRCA1CA2CA7CA9 | |
| Benzyl Alcohol SCHEMBL28118662 | 0.83 | TSHR (0.67) | TSHRCA1CA2CA7CA9 | |
| Benzene SCHEMBL502623 | 0.82 | USP2 (0.46) | TSHRCA1CA2CA7CA9 | |
| Phenol SCHEMBL27431055 | 0.82 | CA1 (0.47) | TSHRCA1CA2CA7CA9 | |
| Phenol SCHEMBL28800037 | 0.82 | CA1 (0.47) | TSHRCA1CA2CA7CA9 | |
| Benzyl Alcohol SCHEMBL21121521 | 0.81 | ALDH1A1 (0.46) | TSHRCA2CYP1A2KDM4ELMNA |
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-104974112-A | o-alkoxy cyclohexanol glycidyl ether and synthetic method thereof | Yueyang changde chemical industry co ltd | 2015-10-14 | — | — | CN | disclosed |