Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 2/20 | 0.34 |
| ▸ | PPARA | Q07869 | 2/20 | 0.33 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.32 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.32 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.32 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 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 | |
|---|---|---|---|---|
| SCHEMBL21331864 | 0.87 | CYP2C9 (0.52) | SLC22A12ALDH1A1KDM4EHSD17B10CYP2C9 | |
| SCHEMBL21333896 | 0.86 | SLC22A12 (0.46) | SLC22A12ALDH1A1KDM4EHSD17B10CYP2C9 | |
| SCHEMBL28411847 | 0.85 | SLC22A12 (0.46) | SLC22A12ALDH1A1KDM4EHSD17B10CYP2C9 | |
| SCHEMBL21331804 | 0.85 | SLC22A12 (0.48) | SLC22A12ALDH1A1KDM4EHSD17B10CYP2C9 | |
| SCHEMBL21331818 | 0.85 | SLC22A12 (0.46) | SLC22A12ALDH1A1KDM4EHSD17B10CYP2C9 | |
| SCHEMBL28411914 | 0.83 | KMT2A (0.39) | SLC22A12ALDH1A1CYP2C9HIF1AACE2 | |
| SCHEMBL21331871 | 0.83 | SLC22A12 (0.41) | SLC22A12ALDH1A1KDM4ECYP2C9HIF1A | |
| SCHEMBL21331844 | 0.82 | SLC22A12 (0.46) | SLC22A12ALDH1A1KDM4EHSD17B10CYP2C9 | |
| SCHEMBL21350535 | 0.82 | SLC22A12 (0.66) | SLC22A12ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL21331808 | 0.79 | SLC22A12 (0.70) | SLC22A12 |
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 2 patents. 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 |
| 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 |