Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.53 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.48 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.48 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.48 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.48 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.48 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.48 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.48 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.48 |
| ▸ | CYP4F8 | P98187 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL14036342 | 0.92 | MAOA (0.52) | ACHECYP1A1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL27948002 | 0.92 | MAOA (0.52) | ACHECYP1A1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL9419197 | 0.92 | ACHE (0.67) | ACHEDHODHMEN1KMT2ARAB9A | |
| Hydrogen Sulfide SCHEMBL27621093 | 0.90 | MAOA (0.50) | ACHECYP1A1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL23518713 | 0.89 | MAOA (0.48) | ACHECYP1A1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL14036343 | 0.89 | MAOA (0.48) | ACHECYP1A1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL30443064 | 0.88 | ACHE (0.61) | ACHECYP1A1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL28043529 | 0.88 | ACHE (0.61) | ACHECYP1A1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL12354295 | 0.86 | ALDH1A1 (0.52) | ACHECYP1A1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL28376833 | 0.86 | MAOA (0.56) | ACHECYP3A4DHODHMEN1ESR1 |
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-114621045-A | Method for synthesizing polyaromatic hydrocarbon from aryl formaldehyde | 长沙资材科技有限公司 | 2022-06-14 | — | — | CN | disclosed |