Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Naphthalene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPI | P09923 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | XIAP | P98170 | 1/20 | 0.52 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.52 |
| ▸ | SLC1A3 | P43003 | 4/20 | 0.50 |
| ▸ | SLC1A2 | P43004 | 4/20 | 0.50 |
| ▸ | SLC1A1 | P43005 | 4/20 | 0.50 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.49 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.49 |
| ▸ | GRIK1 | P39086 | 4/20 | 0.46 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.46 |
| ▸ | GRIK3 | Q13003 | 1/20 | 0.46 |
| ▸ | KIF11 | P52732 | 4/20 | 0.44 |
| ▸ | CPA1 | P15085 | 2/20 | 0.44 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.44 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.44 |
| ▸ | CPB1 | P15086 | 1/20 | 0.44 |
| ▸ | CPA3 | P15088 | 1/20 | 0.44 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL7779541 | 0.86 | SLC1A3 (0.62) | ALPIPKMPTGS1XIAPSLC7A5 | |
| Aspartic Acid SCHEMBL7709515 | 0.84 | SLC7A5 (0.53) | ALPIPKMPTGS1XIAPSLC7A5 | |
| Aspartic Acid SCHEMBL7709510 | 0.84 | SLC7A5 (0.53) | ALPIPKMPTGS1XIAPSLC7A5 | |
| Isoquinoline SCHEMBL28114920 | 0.84 | ROCK2 (0.44) | ALPIPKMPTGS1XIAPSLC7A5 | |
| Phenylalanine SCHEMBL13835334 | 0.83 | SLC7A5 (0.79) | ALPIPKMPTGS1XIAPSLC7A5 | |
| Aspartic Acid SCHEMBL2459025 | 0.82 | GRIK1 (0.54) | PTGS1SLC7A5SLC1A3SLC1A2SLC1A1 | |
| Aspartic Acid SCHEMBL28335077 | 0.82 | GRIK1 (0.54) | PTGS1SLC7A5SLC1A3SLC1A2SLC1A1 | |
| Aspartic Acid SCHEMBL15401937 | 0.82 | GRIK1 (0.54) | PTGS1SLC7A5SLC1A3SLC1A2SLC1A1 | |
| Aspartic Acid SCHEMBL2459027 | 0.82 | GRIK1 (0.54) | PTGS1SLC7A5SLC1A3SLC1A2SLC1A1 | |
| Aspartic Acid SCHEMBL10494124 | 0.82 | GRIK1 (0.54) | PTGS1SLC7A5SLC1A3SLC1A2SLC1A1 |
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-109618698-A | A kind of Taiwan leaflet V. amurensis cuttage and seedling culture method | 福建省亚热带植物研究所 | 2019-04-16 | — | — | CN | claimed |