Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | GAA | P10253 | 4/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 7/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KHK | P50053 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24517477 | 1.00 | ALDH1A1 (0.41) | ALDH1A1KDM4EGAAADORA1HSD17B10 | |
| SCHEMBL29664488 | 0.79 | NPSR1 (0.37) | ALDH1A1KDM4EGAAADORA1HSD17B10 | |
| SCHEMBL24517531 | 0.79 | NPSR1 (0.37) | ALDH1A1KDM4EGAAADORA1HSD17B10 | |
| SCHEMBL31168655 | 0.73 | CRHBP (0.37) | ALDH1A1GAAADORA1NPSR1ADORA2A | |
| SCHEMBL29664537 | 0.73 | HSP90AA1 (0.35) | KMT2AHTT | |
| SCHEMBL1622661 | 0.72 | MAPT (0.43) | ALDH1A1KDM4EGAAADORA1HSD17B10 | |
| SCHEMBL24517473 | 0.71 | KDM4E (0.40) | ALDH1A1KDM4EGAAADORA1HSD17B10 | |
| SCHEMBL29618324 | 0.71 | KDM4E (0.40) | ALDH1A1KDM4EGAAADORA1HSD17B10 | |
| SCHEMBL27883168 | 0.70 | KDM4E (0.57) | ALDH1A1KDM4EGAAHSD17B10USP2 | |
| SCHEMBL26639929 | 0.69 | HPGD (0.39) | ALDH1A1KDM4EGAAADORA1HSD17B10 |
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-2022121805-A1 | FUSED RING COMPOUND AS NAV1.8 INHIBITOR AND USE THEREOF | 成都康弘药业集团股份有限公司 | 2022-06-16 | — | — | WO | disclosed |