Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 5/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.35 |
| ▸ | PLA2G5 | P39877 | 1/20 | 0.35 |
| ▸ | KLK7 | P49862 | 1/20 | 0.35 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14141084 | 1.00 | CHRM2 (0.40) | CHRM2CHRM1CHRM3NR1H2NR1H3 | |
| SCHEMBL31080746 | 0.87 | CHRM2 (0.36) | CHRM2CHRM1CHRM3NR1H2NR1H3 | |
| SCHEMBL31080396 | 0.86 | CHRM2 (0.45) | CHRM2CHRM1CHRM3NR1H2NR1H3 | |
| SCHEMBL31080165 | 0.86 | CHRM2 (0.45) | CHRM2CHRM1CHRM3NR1H2NR1H3 | |
| SCHEMBL29624640 | 0.85 | CHRM2 (0.41) | CHRM2CHRM1CHRM3NR1H2NR1H3 | |
| SCHEMBL18987136 | 0.85 | CHRM2 (0.41) | CHRM2CHRM1CHRM3NR1H2NR1H3 | |
| SCHEMBL4035983 | 0.85 | CHRM2 (0.41) | CHRM2CHRM1CHRM3NR1H2NR1H3 | |
| SCHEMBL4035987 | 0.85 | CHRM2 (0.41) | CHRM2CHRM1CHRM3NR1H2NR1H3 | |
| SCHEMBL16224801 | 0.79 | CHRM2 (0.41) | CHRM2CHRM1CHRM3NR1H2MAPT | |
| SCHEMBL34475689 | 0.77 | CHRM2 (0.38) | CHRM2CHRM1CHRM3NR1H2MAPT |
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 |