Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 1.00 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.66 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.66 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.54 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.54 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.54 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.53 |
| ▸ | HRH1 | P35367 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8363021 | 1.00 | CHRNA7 (1.00) | CHRNA7CHRNB2CHRNA4TAAR1TDP1 | |
| SCHEMBL11846860 | 0.89 | CHRNA7 (0.79) | CHRNA7CHRNB2CHRNA4TDP1L3MBTL1 | |
| SCHEMBL7751185 | 0.87 | CHRNA7 (0.77) | CHRNA7CHRNB2CHRNA4TDP1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL7744066 | 0.85 | CHRNA7 (0.74) | CHRNA7CHRNB2CHRNA4TDP1L3MBTL1 | |
| SCHEMBL8009741 | 0.83 | CHRNA7 (0.70) | CHRNA7CHRNB2CHRNA4TDP1L3MBTL1 | |
| SCHEMBL17886908 | 0.82 | CHRNA7 (0.69) | CHRNA7CHRNB2CHRNA4TDP1L3MBTL1 | |
| SCHEMBL12088731 | 0.82 | CHRNA7 (0.69) | CHRNA7CHRNB2CHRNA4TDP1L3MBTL1 | |
| SCHEMBL19632213 | 0.81 | CHRNA7 (0.67) | CHRNA7CHRNB2CHRNA4TDP1L3MBTL1 | |
| SCHEMBL13541822 | 0.81 | CHRNA7 (0.68) | CHRNA7CHRNB2CHRNA4TDP1L3MBTL1 | |
| SCHEMBL5349780 | 0.80 | CHRNA7 (0.67) | CHRNA7CHRNB2CHRNA4TDP1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117580836-A | Pyrimidine ring structure derivative and application thereof | 四川汇宇制药股份有限公司 | 2024-02-20 | — | — | CN | disclosed |