Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 20/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.48 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL21331814 | 0.90 | SLC22A12 (0.77) | SLC22A12SLC22A6SLC22A11 | |
| SCHEMBL21331809 | 0.88 | SLC22A12 (0.74) | SLC22A12SLC22A6SLC22A11 | |
| SCHEMBL21331872 | 0.88 | SLC22A12 (0.74) | SLC22A12SLC22A6SLC22A11 | |
| SCHEMBL21333891 | 0.87 | SLC22A12 (0.72) | SLC22A12SLC22A6SLC22A11 | |
| SCHEMBL21333899 | 0.85 | SLC22A12 (0.70) | SLC22A12CYP2C9SLC22A6SLC22A11 | |
| SCHEMBL21331808 | 0.85 | SLC22A12 (0.70) | SLC22A12SLC22A6SLC22A11 | |
| SCHEMBL21350524 | 0.84 | SLC22A12 (1.00) | SLC22A12SLC22A6SLC22A11 | |
| SCHEMBL21350526 | 0.84 | SLC22A12 (0.68) | SLC22A12SLC22A6SLC22A11 | |
| SCHEMBL21331855 | 0.83 | SLC22A12 (0.67) | SLC22A12SLC22A6SLC22A11 | |
| SCHEMBL12070782 | 0.81 | SLC22A12 (1.00) | SLC22A12SLC22A6SLC22A11 |
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-108440397-B | 3- (naphthalene-1-methyl substituted) pyridine derivative and synthesis method and application thereof | 南方医科大学 | 2020-06-05 | — | — | CN | disclosed |