Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.48 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | ESRRG | P62508 | 3/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL177465 | 1.00 | NLRP3 (0.51) | NLRP3HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL9946007 | 0.90 | HDAC3 (0.47) | NLRP3HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL21439215 | 0.87 | HDAC3 (0.46) | NLRP3HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL23048230 | 0.86 | RXFP1 (0.46) | NLRP3HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL29029431 | 0.85 | HDAC3 (0.56) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL3783971 | 0.84 | NLRP3 (0.59) | NLRP3TRPV1ESRRGESR1ESR2 | |
| SCHEMBL3789278 | 0.84 | CA12 (0.42) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL9893568 | 0.83 | HDAC3 (0.42) | NLRP3HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL10269469 | 0.83 | CA1 (0.45) | NLRP3HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL2055341 | 0.82 | CA1 (0.45) | HDAC3HDAC1HDAC2HDAC8HDAC6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117651696-A | Vinyl thianthrene onium compounds, method for the production thereof and use thereof for transferring vinyl groups | 科勒研究非盈利有限责任公司 | 2024-03-05 | — | — | CN | disclosed |
| WO-2023280638-A9 | VINYL THIANTHRENIUM COMPOUND, PROCESS FOR ITS PREPARATION AND ITS USE FOR TRANSFERRING A VINYL GROUP | STUDIENGESELLSCHAFT KOHLE GGMBH (DE) | 2024-01-18 | — | — | WO | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |