Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.36 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL20037485 | 0.84 | PTPN11 (0.37) | CHRNB2CHRNA4CHRNB4CHRNA3HRH4 | |
| SCHEMBL20037487 | 0.84 | PTPN11 (0.37) | CHRNB2CHRNA4CHRNB4CHRNA3HRH4 | |
| SCHEMBL20037483 | 0.83 | PIK3CA (0.37) | CHRNB2CHRNA4CHRNB4CHRNA3MAP4K4 | |
| SCHEMBL13768874 | 0.81 | SMPD3 (0.40) | CHRNB2CHRNA4CHRNB4CHRNA3CDK4 | |
| SCHEMBL18291535 | 0.81 | SMPD3 (0.40) | CHRNB2CHRNA4CHRNB4CHRNA3CDK4 | |
| SCHEMBL18291514 | 0.79 | MAP4K4 (0.37) | CHRNB2CHRNA4CHRNB4CHRNA3MAP4K4 | |
| SCHEMBL20037484 | 0.79 | NMT1 (0.37) | HRH4HRH3 | |
| SCHEMBL18291073 | 0.79 | HRH4 (0.36) | CHRNB2CHRNA4CHRNB4CHRNA3HRH4 | |
| SCHEMBL18291518 | 0.79 | MAP4K4 (0.37) | CHRNB2CHRNA4CHRNB4CHRNA3MAP4K4 | |
| SCHEMBL20255186 | 0.79 | NMT1 (0.37) | HRH4HRH3 |
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-2019079783-A1 | ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 | VANDERBILT UNIVERSITY (US) | 2019-04-25 | — | — | WO | disclosed |