Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ANPEP | P15144 | 2/20 | 0.37 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.37 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22265816 | 0.74 | ALDH1A1 (0.51) | BLMALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL22280026 | 0.73 | TSHR (0.44) | BLMALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL22012921 | 0.73 | — | — | |
| SCHEMBL28617355 | 0.72 | ALDH1A1 (0.44) | BLMALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL21913927 | 0.70 | ALDH1A1 (0.46) | ALDH1A1CYP1A2CYP2C9CYP2C19ANPEP | |
| SCHEMBL21186525 | 0.69 | ALDH1A1 (0.49) | ALDH1A1CYP1A2CYP2C9CYP2C19ANPEP | |
| SCHEMBL6720359 | 0.69 | ALDH1A1 (0.53) | ALDH1A1CYP1A2CYP2C9CYP2C19ANPEP | |
| SCHEMBL21722661 | 0.68 | CA1 (0.42) | ALDH1A1CYP2C19TSHRCA1CA2 | |
| SCHEMBL6720360 | 0.68 | ALDH1A1 (0.51) | BLMALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL21186495 | 0.66 | POLB (0.44) | ALDH1A1CYP1A2CYP2C9CYP2C19TSHR |
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-2020154321-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-07-30 | — | — | WO | disclosed |