Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGK1 | P00558 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL29130907 | 1.00 | PGK1 (0.35) | PGK1ALDH1A1MAPTHPGDTDP1 | |
| SCHEMBL30602424 | 0.79 | MAPT (0.36) | PGK1ALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL29131000 | 0.79 | MAPT (0.36) | PGK1ALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL29549876 | 0.70 | ALDH1A1 (0.45) | PGK1ALDH1A1HPGDTDP1SMN1; SMN2 | |
| SCHEMBL29549875 | 0.70 | ALDH1A1 (0.45) | PGK1ALDH1A1HPGDTDP1SMN1; SMN2 | |
| SCHEMBL2047755 | 0.70 | ALDH1A1 (0.45) | PGK1ALDH1A1HPGDTDP1SMN1; SMN2 | |
| SCHEMBL12093320 | 0.69 | PGK1 (0.36) | PGK1ALDH1A1MAPTHTTSMN1; SMN2 | |
| SCHEMBL16235287 | 0.68 | RAB9A (0.38) | ALDH1A1HTTSMN1; SMN2RAB9ALMNA | |
| SCHEMBL22042633 | 0.67 | CYP3A4 (0.37) | PGK1ALDH1A1MAPTSMN1; SMN2NPC1 | |
| SCHEMBL15687643 | 0.67 | GAA (0.42) | PGK1ALDH1A1TDP1NPC1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-117069724-A | Fused ring compounds, pharmaceutical compositions and uses | 上海赛默罗德生物科技有限公司 | 2023-11-17 | — | — | CN | disclosed |