Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 5/20 | 0.55 |
| ▸ | NPC1 | O15118 | 4/20 | 0.55 |
| ▸ | RAB9A | P51151 | 4/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | CASP3 | P42574 | 1/20 | 0.53 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.53 |
| ▸ | RELA | Q04206 | 1/20 | 0.53 |
| ▸ | ESR1 | P03372 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7339923 | 0.87 | RAB9A (0.55) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL8208699 | 0.81 | CYP1A2 (0.64) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL13550378 | 0.80 | ALDH1A1 (0.60) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL83331 | 0.80 | RAB9A (0.79) | ALDH1A1HPGDNPC1RAB9AL3MBTL1 | |
| SCHEMBL11232608 | 0.79 | SMN1; SMN2 (0.58) | ALDH1A1HPGDNPC1RAB9AL3MBTL1 | |
| SCHEMBL17010765 | 0.79 | L3MBTL1 (0.62) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL29043248 | 0.78 | RAB9A (0.77) | ALDH1A1HPGDNPC1RAB9AL3MBTL1 | |
| SCHEMBL22319774 | 0.78 | RAB9A (0.71) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL16398834 | 0.78 | RAB9A (0.71) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL7082017 | 0.78 | NPC1 (0.79) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD |
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-117089707-A | Method for reducing halogen-containing pollutant content in wire enamel and polyvinyl chloride co-pyrolysis product | 北京工业大学 | 2023-11-21 | — | — | CN | disclosed |