Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAP3K12 | Q12852 | 2/20 | 0.34 |
| ▸ | RET | P07949 | 2/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL25465986 | 0.74 | L3MBTL1 (0.31) | ALDH1A1L3MBTL1 | |
| SCHEMBL19857578 | 0.72 | COMT (0.35) | ALDH1A1L3MBTL1 | |
| SCHEMBL28723687 | 0.71 | ALDH1A1 (0.34) | ALDH1A1NR3C2 | |
| SCHEMBL1628593 | 0.70 | — | — | |
| SCHEMBL25564431 | 0.68 | ALDH1A1 (0.42) | ALDH1A1NR3C2L3MBTL1 | |
| SCHEMBL25562705 | 0.68 | ALDH1A1 (0.35) | ALDH1A1NR3C2 | |
| SCHEMBL19696509 | 0.68 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL19696508 | 0.68 | ALDH1A1 (0.38) | ALDH1A1NR3C2 | |
| SCHEMBL1487464 | 0.67 | — | — | |
| SCHEMBL19507969 | 0.67 | MAP3K12 (0.45) | MAP3K12RET |
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-2020102576-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |