Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 2/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21801196 | 0.77 | CHRNB2 (0.37) | GAACHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL21084340 | 0.75 | CHRNB2 (0.36) | GAACHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL17802846 | 0.75 | MAPT (0.47) | GAAALDH1A1POLB | |
| SCHEMBL21451205 | 0.75 | CHRNB2 (0.44) | GAACHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL21403867 | 0.74 | GABRA1 (0.39) | — | |
| SCHEMBL17802899 | 0.74 | PLG (0.39) | GAASMN1; SMN2ALDH1A1ACACB | |
| SCHEMBL13191752 | 0.73 | GAA (0.40) | GAACHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL5722414 | 0.73 | CHRNB2 (0.39) | GAACHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL24906947 | 0.72 | CHRNB2 (0.52) | GAACHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL13738413 | 0.72 | CHRNB2 (0.52) | GAACHRNB2CHRNA4CHRNB4CHRNA3 |
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-2007025949-A1 | NOVEL CYCLOALKANE CARBOXAMIDES AS FACTOR XA INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-03-08 | — | — | WO | disclosed |