Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALB | P02768 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14149657 | 0.88 | ALDH1A1 (0.53) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL8783994 | 0.88 | ALDH1A1 (0.53) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL22643725 | 0.81 | ALDH1A1 (0.39) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL19392061 | 0.80 | ALDH1A1 (0.38) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL19391966 | 0.80 | ALDH1A1 (0.38) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL19391963 | 0.80 | ALDH1A1 (0.38) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL22800480 | 0.80 | ALDH1A1 (0.38) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL21427363 | 0.79 | ALDH1A1 (0.40) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL21393030 | 0.79 | ALDH1A1 (0.40) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL14149655 | 0.79 | ALDH1A1 (0.40) | ALDH1A1LMNAALBMAPK1DNMT3B |
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-2019180683-A1 | STING MODULATOR COMPOUNDS WITH SULFAMATE LINKAGES, AND METHODS OF MAKING AND USING | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2019-09-26 | — | — | WO | disclosed |