Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 17/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21331844 | 0.89 | SLC22A12 (0.46) | SLC22A12CYP3A4CYP2C9SSTR4HSD11B1 | |
| SCHEMBL21350904 | 0.85 | SLC22A12 (0.40) | SLC22A12CYP3A4CYP2C9 | |
| SCHEMBL21331848 | 0.77 | SLC22A12 (0.48) | SLC22A12CYP3A4CYP2C9 | |
| SCHEMBL28414576 | 0.77 | SLC22A12 (0.46) | SLC22A12CYP3A4CYP2C9KDM4C | |
| SCHEMBL21350902 | 0.75 | SLC22A12 (0.41) | SLC22A12 | |
| SCHEMBL21333896 | 0.74 | SLC22A12 (0.46) | SLC22A12CYP2C9 | |
| SCHEMBL21331818 | 0.73 | SLC22A12 (0.46) | SLC22A12CYP2C9 | |
| SCHEMBL21331804 | 0.73 | SLC22A12 (0.48) | SLC22A12CYP3A4CYP2C9 | |
| SCHEMBL21331864 | 0.73 | CYP2C9 (0.52) | SLC22A12CYP3A4CYP2C9 | |
| SCHEMBL28411847 | 0.73 | SLC22A12 (0.46) | SLC22A12CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019169890-A1 | 3-(NAPHTHALENE-1-METHYL SUBSTITUTED)PYRIDINE DERIVATIVE, SYNTHETIC METHOD THEREFOR AND USE THEREOF | 南方医科大学 | 2019-09-12 | — | — | WO | disclosed |