Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 9/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.54 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.40 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | CASP1 | P29466 | 2/20 | 0.40 |
| ▸ | CASP7 | P55210 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | GCK | P35557 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29196336 | 0.94 | SMN1; SMN2 (0.52) | SMN1; SMN2ALDH1A1RAB9ANPC1NPSR1 | |
| SCHEMBL28922096 | 0.80 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1RAB9ANPC1NPSR1 | |
| SCHEMBL29196372 | 0.77 | ACHE (0.60) | ALDH1A1KDM4EHSD17B10GAAMAPT | |
| SCHEMBL29196405 | 0.77 | SMN1; SMN2 (0.45) | SMN1; SMN2ALDH1A1RAB9ANPC1NPSR1 | |
| SCHEMBL29196388 | 0.75 | SMN1; SMN2 (0.47) | SMN1; SMN2ALDH1A1RAB9ANPC1NPSR1 | |
| SCHEMBL29196362 | 0.73 | CYP1A1 (0.43) | ALDH1A1RAB9ANPC1KDM4EBCHE | |
| SCHEMBL29196401 | 0.73 | SMN1; SMN2 (0.45) | SMN1; SMN2ALDH1A1RAB9ANPC1NPSR1 | |
| SCHEMBL29196398 | 0.71 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1RAB9ANPC1NPSR1 | |
| SCHEMBL30723298 | 0.71 | SMN1; SMN2 (0.43) | SMN1; SMN2ALDH1A1RAB9AKDM4EHSD17B10 | |
| SCHEMBL12457528 | 0.70 | SMN1; SMN2 (1.00) | SMN1; SMN2ALDH1A1RAB9ANPC1KDM4E |
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 |