Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | KLK7 | P49862 | 2/20 | 0.36 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.36 |
| ▸ | MME | P08473 | 1/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.33 |
| ▸ | PLA2G5 | P39877 | 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 | |
|---|---|---|---|---|
| SCHEMBL581822 | 0.88 | CHRM2 (0.34) | CHRM2CHRM1CHRM3KLK7KLK5 | |
| SCHEMBL8021097 | 0.82 | CHRM2 (0.42) | CHRM2CHRM1CHRM3KLK7KLK5 | |
| SCHEMBL29405280 | 0.81 | CHRM2 (0.35) | CHRM2CHRM1CHRM3KLK7KLK5 | |
| SCHEMBL13733627 | 0.80 | KLK7 (0.35) | CHRM2CHRM1CHRM3KLK7KLK5 | |
| SCHEMBL248703 | 0.78 | MME (0.43) | MMEMAPTALDH1A1POLB | |
| SCHEMBL20734866 | 0.78 | KLK7 (0.36) | CHRM2CHRM1CHRM3KLK7KLK5 | |
| SCHEMBL20734867 | 0.78 | KLK7 (0.36) | CHRM2CHRM1CHRM3KLK7KLK5 | |
| SCHEMBL29060299 | 0.77 | KLK7 (0.35) | CHRM2CHRM1CHRM3KLK7KLK5 | |
| SCHEMBL14141084 | 0.76 | CHRM2 (0.40) | CHRM2CHRM1CHRM3KLK7KLK5 | |
| SCHEMBL3378115 | 0.76 | CHRM2 (0.40) | CHRM2CHRM1CHRM3KLK7KLK5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012000608-A2 | NOVEL BETA-AMINOALDEHYDE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR CHEMICAL USE AS REACTIVE INTERMEDIATES | GLUESENKAMP KARL-HEINZ (DE) | 2012-01-05 | — | — | WO | disclosed |