Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | BPTF | Q12830 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24478599 | 0.83 | GAA (0.34) | CYP1A2GAAKDM4EMAPTMEN1 | |
| SCHEMBL22020517 | 0.80 | ACHE (0.48) | CYP1A2GAAKDM4EMAPTMEN1 | |
| SCHEMBL22019720 | 0.79 | KDM4E (0.36) | NLRP3KDM4EMEN1KMT2AMAPK1 | |
| SCHEMBL30120743 | 0.76 | ACHE (0.57) | CYP1A2KDM4EMEN1KMT2AMAPK1 | |
| SCHEMBL22020021 | 0.76 | ACHE (0.57) | CYP1A2KDM4EMEN1KMT2AMAPK1 | |
| SCHEMBL12507981 | 0.76 | ACHE (0.50) | CYP1A2GAAKDM4EMAPTMEN1 | |
| SCHEMBL22019939 | 0.75 | USP2 (0.33) | NLRP3KDM4EMEN1KMT2AMAPK1 | |
| SCHEMBL24872239 | 0.75 | NLRP3 (0.35) | NLRP3KDM4EMEN1KMT2AMAPK1 | |
| SCHEMBL22265389 | 0.72 | NLRP3 (0.43) | CYP1A2GAANLRP3KDM4EMAPT | |
| SCHEMBL22021154 | 0.69 | NLRP3 (0.44) | CYP1A2GAANLRP3KDM4EMAPT |
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-2020102096-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |