Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 6/20 | 0.34 |
| ▸ | RAB9A | P51151 | 5/20 | 0.34 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | NCOA2 | Q15596 | 2/20 | 0.34 |
| ▸ | NCOA1 | Q15788 | 2/20 | 0.34 |
| ▸ | NCOA3 | Q9Y6Q9 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24517531 | 1.00 | NPSR1 (0.37) | NPSR1HSD17B10ALDH1A1RXFP1GAA | |
| SCHEMBL29664483 | 0.79 | ALDH1A1 (0.41) | NPSR1HSD17B10ALDH1A1RXFP1GAA | |
| SCHEMBL24517477 | 0.79 | ALDH1A1 (0.41) | NPSR1HSD17B10ALDH1A1RXFP1GAA | |
| SCHEMBL4145121 | 0.72 | NPC1 (0.40) | NPSR1HSD17B10ALDH1A1RXFP1GAA | |
| SCHEMBL26639929 | 0.69 | HPGD (0.39) | NPSR1HSD17B10ALDH1A1RXFP1GAA | |
| SCHEMBL26639798 | 0.67 | MAPT (0.37) | NPSR1HSD17B10ALDH1A1RXFP1GAA | |
| SCHEMBL24517530 | 0.65 | KDM4E (0.45) | NPSR1HSD17B10ALDH1A1RXFP1GAA | |
| SCHEMBL14172609 | 0.64 | CYP3A4 (0.42) | NPSR1HSD17B10ALDH1A1RXFP1GAA | |
| SCHEMBL10979117 | 0.64 | MAPT (0.47) | NPSR1HSD17B10ALDH1A1RXFP1GAA | |
| SCHEMBL1622661 | 0.64 | MAPT (0.43) | NPSR1HSD17B10ALDH1A1RXFP1GAA |
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 |