Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 6/20 | 0.43 |
| ▸ | FEN1 | P39748 | 6/20 | 0.43 |
| ▸ | CRHR1 | P34998 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MBOAT4 | Q96T53 | 3/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 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 | |
|---|---|---|---|---|
| SCHEMBL31314375 | 1.00 | ALOX5AP (0.43) | ALOX5APFEN1CRHR1LMNAMAPT | |
| SCHEMBL26439270 | 0.87 | CRHR1 (0.41) | ALOX5APFEN1CRHR1LMNAMAPT | |
| SCHEMBL31314286 | 0.84 | ALOX5AP (0.42) | ALOX5APFEN1CRHR1LMNAMAPT | |
| SCHEMBL31314251 | 0.81 | CACNA2D1 (0.33) | ATM | |
| SCHEMBL25857680 | 0.81 | S1PR1 (0.36) | — | |
| SCHEMBL25859018 | 0.80 | CACNA2D1 (0.34) | ATMADORA2AADORA1 | |
| SCHEMBL25857437 | 0.80 | DHFR (0.40) | MAPTL3MBTL1 | |
| SCHEMBL31314385 | 0.80 | DHFR (0.40) | MAPTL3MBTL1 | |
| SCHEMBL31314270 | 0.79 | ALOX5AP (0.41) | ALOX5APFEN1CRHR1LMNAMAPT | |
| SCHEMBL25859156 | 0.77 | CHRNB2 (0.37) | — |
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-2023131277-A1 | NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF | 药捷安康(南京)科技股份有限公司 | 2023-07-13 | — | — | WO | disclosed |