Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 8/20 | 0.57 |
| ▸ | CHRNA4 | P43681 | 8/20 | 0.57 |
| ▸ | CHRNB4 | P30926 | 5/20 | 0.55 |
| ▸ | CHRNA3 | P32297 | 5/20 | 0.55 |
| ▸ | HRH4 | Q9H3N8 | 9/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4827594 | 1.00 | CHRNB2 (0.57) | CHRNB2CHRNA4CHRNB4CHRNA3HRH4 | |
| SCHEMBL4827593 | 0.82 | CHRNB2 (0.58) | CHRNB2CHRNA4CHRNB4CHRNA3HRH4 | |
| SCHEMBL4827564 | 0.82 | CHRNB2 (0.58) | CHRNB2CHRNA4CHRNB4CHRNA3HRH4 | |
| SCHEMBL4819971 | 0.81 | ROCK2 (0.52) | HRH4 | |
| SCHEMBL4825453 | 0.81 | ROCK2 (0.52) | HRH4 | |
| SCHEMBL4827811 | 0.79 | ROCK2 (0.56) | CHRNB2CHRNA4CHRNB4CHRNA3HRH4 | |
| SCHEMBL4821451 | 0.79 | ROCK2 (0.56) | CHRNB2CHRNA4CHRNB4CHRNA3HRH4 | |
| SCHEMBL30637194 | 0.78 | CHRNB2 (0.53) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL26106137 | 0.78 | CHRNB2 (0.53) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL26104729 | 0.78 | CHRNB2 (0.53) | CHRNB2CHRNA4CHRNB4CHRNA3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7332504-B2 | Heterocyclic substituted aminoazacycles useful as central nervous system agents | ABBOTT LABORATORIES (US) | 2008-02-19 | — | — | US | claimed |
| US-7332504-B2 | Heterocyclic substituted aminoazacycles useful as central nervous system agents | ABBOTT LABORATORIES (US) | 2008-02-19 | — | — | US | disclosed |