Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALB | P02768 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | ATG7 | O95352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | THPO | P40225 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
| ▸ | RIN1 | Q13671 | 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 | |
|---|---|---|---|---|
| SCHEMBL21393211 | 0.88 | ALDH1A1 (0.40) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL14149657 | 0.82 | ALDH1A1 (0.53) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL8783994 | 0.82 | ALDH1A1 (0.53) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL21393028 | 0.80 | DNMT3B (0.38) | DNMT3BFDPSHDAC1HDAC6ATG7 | |
| SCHEMBL21637027 | 0.80 | ALDH1A1 (0.44) | ALDH1A1LMNAALBMAPK1CYP1A2 | |
| SCHEMBL21392957 | 0.80 | BLM (0.55) | ALDH1A1LMNAALBMAPK1CYP1A2 | |
| SCHEMBL21393029 | 0.79 | ALDH1A1 (0.41) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL21427363 | 0.76 | ALDH1A1 (0.40) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL14149655 | 0.76 | ALDH1A1 (0.40) | ALDH1A1LMNAALBMAPK1DNMT3B | |
| SCHEMBL20324736 | 0.76 | FDPS (0.40) | ALDH1A1LMNAALBMAPK1FDPS |
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 |