Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CCR4 | P51679 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PDE5A | O76074 | 2/20 | 0.39 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.39 |
| ▸ | MPI | P34949 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29196372 | 0.80 | ACHE (0.60) | CYP1A2KDM4EALDH1A1BCHEACHE | |
| SCHEMBL29196336 | 0.79 | SMN1; SMN2 (0.52) | HRH3KCNH2KDM4EALDH1A1NPC1 | |
| SCHEMBL1462716 | 0.75 | HRH3 (0.51) | HRH3KCNH2CYP3A4KDM4EALDH1A1 | |
| SCHEMBL29196326 | 0.73 | SMN1; SMN2 (0.54) | HRH3KCNH2KDM4EALDH1A1NPC1 | |
| SCHEMBL31562973 | 0.70 | NPC1 (0.62) | CYP1A1CYP1A2CYP1B1KDM4EALDH1A1 | |
| SCHEMBL30723297 | 0.69 | ALDH1A1 (0.47) | CYP1A1CYP1A2CYP1B1HRH3KCNH2 | |
| SCHEMBL28922103 | 0.68 | CYP1A1 (0.43) | CYP1A1CYP1A2CYP1B1HRH3CYP3A4 | |
| SCHEMBL30723312 | 0.67 | SMN1; SMN2 (0.39) | HRH3NPC1RAB9ABCHEACHE | |
| SCHEMBL6921312 | 0.67 | ALDH1A1 (0.52) | ALDH1A1NPC1RAB9A | |
| SCHEMBL28922093 | 0.66 | ACHE (0.45) | CYP1A1CYP1A2CYP1B1CYP3A4KDM4E |
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-117924292-A | Preparation method of alkylated 2, 3-condensed quinazolinone compound | 惠州学院 | 2024-04-26 | — | — | CN | disclosed |