Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 12/20 | 0.41 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24288061 | 0.72 | CHRNB4 (0.40) | CHRM3ALDH1A1 | |
| SCHEMBL24288142 | 0.70 | HRH4 (0.41) | CHRM3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL30837992 | 0.69 | HRH4 (0.40) | CHRM3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL30837986 | 0.65 | CHRM3 (0.47) | CHRM3ACKR3 | |
| SCHEMBL24288104 | 0.65 | CHRM3 (0.44) | CHRM3ACKR3 | |
| SCHEMBL13309881 | 0.64 | ACKR3 (0.54) | CHRM3ACKR3 | |
| SCHEMBL24288253 | 0.63 | CHRNB4 (0.42) | CHRM3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL30838076 | 0.62 | CHRNB4 (0.42) | CHRM3ALDH1A1 | |
| SCHEMBL17840197 | 0.61 | CHRM3 (0.56) | CHRM3ACKR3 | |
| SCHEMBL17840199 | 0.61 | CHRM3 (0.56) | CHRM3ACKR3 |
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 |