Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| Adamantane SCHEMBL28785912 | 0.69 | CYP2C9 (0.40) | CYP2C9 | |
| Adamantane SCHEMBL12761 | 0.68 | CYP2C9 (0.46) | CYP2C9EPHX2HSD11B1 | |
| Adamantane SCHEMBL1527414 | 0.68 | CYP2C9 (0.46) | CYP2C9EPHX2HSD11B1 | |
| Adamantane SCHEMBL29707714 | 0.68 | CYP2C9 (0.46) | CYP2C9EPHX2HSD11B1 | |
| Adamantane SCHEMBL9016497 | 0.68 | CYP2C9 (0.46) | CYP2C9EPHX2HSD11B1 | |
| SCHEMBL2189873 | 0.67 | CYP2C9 (0.50) | CYP2C9EPHX2HSD11B1CYP2A13CA1 | |
| SCHEMBL10459155 | 0.64 | CYP2C9 (0.47) | CYP2C9EPHX2HSD11B1CYP2A13CA1 | |
| Adamantane SCHEMBL25252048 | 0.63 | CYP2C9 (0.43) | CYP2C9EPHX2 | |
| Adamantane SCHEMBL21820021 | 0.63 | CYP2C9 (0.43) | CYP2C9EPHX2 | |
| Adamantane SCHEMBL21192802 | 0.63 | CYP2C9 (0.43) | CYP2C9EPHX2 |
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-4424387-A | STRONG ACID, BRANCHING | EXXON RESEARCH AND ENGINEERING CO. (US) | 1984-01-03 | — | — | US | disclosed |