Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 4/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 6/20 | 0.34 |
| ▸ | WNT1 | P04628 | 2/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL989196 | 0.73 | CHRNA7 (0.43) | CHRNA7KCNH2CHRNB2CHRNA4DYRK1A | |
| Fumaric Acid SCHEMBL989195 | 0.73 | CHRNA7 (0.43) | CHRNA7KCNH2CHRNB2CHRNA4DYRK1A | |
| SCHEMBL748444 | 0.70 | CHRNA7 (0.48) | CHRNA7KCNH2CHRNB2CHRNA4DYRK1A | |
| SCHEMBL744853 | 0.70 | CHRNA7 (0.48) | CHRNA7KCNH2CHRNB2CHRNA4DYRK1A | |
| Fumaric Acid SCHEMBL747023 | 0.64 | CHRNA7 (0.47) | CHRNA7KCNH2SLC6A2SLC6A3 | |
| Trifluoroacetic Acid SCHEMBL744720 | 0.63 | CHRNA7 (0.47) | CHRNA7KCNH2CHRNB2CHRNA4DYRK1A | |
| Trifluoroacetic Acid SCHEMBL4114805 | 0.63 | KCNH2 (0.45) | CHRNA7KCNH2CHRNB2CHRNA4DYRK1A | |
| SCHEMBL744858 | 0.62 | KCNH2 (0.56) | CHRNA7KCNH2CHRNB2CHRNA4SLC6A2 | |
| SCHEMBL989197 | 0.62 | CHRNA7 (0.39) | CHRNA7KCNH2DYRK1AWNT1GSK3B | |
| Trifluoroacetic Acid SCHEMBL747090 | 0.61 | CHRNA7 (0.51) | CHRNA7KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2431368-A1 | CNS active fused bicycloheterocycle substituted azabicyclic alkane derivatives | Abbott Laboratories (US) | 2012-03-21 | — | — | EP | disclosed |