Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 8/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.39 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.39 |
| ▸ | CHRNB3 | Q05901 | 2/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL30837986 | 0.76 | CHRM3 (0.47) | CHRM3ACKR3 | |
| SCHEMBL24288064 | 0.75 | ALDH1A1 (0.47) | — | |
| SCHEMBL24288146 | 0.73 | HRH4 (0.42) | CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3 | |
| SCHEMBL24288101 | 0.72 | IL1B (0.39) | CHRM3 | |
| Hydrochloric Acid SCHEMBL30838088 | 0.72 | ALDH1A1 (0.44) | — | |
| SCHEMBL27095229 | 0.70 | VNN1 (0.42) | CHRNB2CHRNB1CHRNB4CHRNA3CHRNB3 | |
| SCHEMBL24288090 | 0.69 | HRH4 (0.45) | CHRM3 | |
| SCHEMBL27095200 | 0.69 | MAPK8 (0.39) | — | |
| SCHEMBL30838085 | 0.69 | APP (0.45) | CHRM3 | |
| Hydrochloric Acid SCHEMBL30838015 | 0.69 | HRH4 (0.45) | CHRM3 |
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-2022053823-A1 | SUBSTITUTED PYRIMIDINE DERIVATIVES AS NICOTINIC ACETYLCHOLINESTERASE RECEPTOR ALPHA 6 MODULATOR | Cerevance, Inc. (US) | 2022-03-17 | — | — | WO | disclosed |