Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 7/20 | 1.00 |
| ▸ | CHRM3 | P20309 | 6/20 | 1.00 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.64 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.57 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 2/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.45 |
| ▸ | XIAP | P98170 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28928351 | 0.87 | CHRM2 (0.75) | CHRM2CHRM3CHRM4CHRM1ALDH1A1 | |
| SCHEMBL4572832 | 0.81 | CHRM2 (0.68) | CHRM2CHRM3CHRM4HDAC1HDAC6 | |
| SCHEMBL29930663 | 0.78 | CHRM2 (1.00) | CHRM2CHRM3CHRM4CHRM1ALDH1A1 | |
| SCHEMBL29930872 | 0.74 | CHRM2 (0.63) | CHRM2CHRM3CHRM4CHRM1HDAC1 | |
| SCHEMBL22225699 | 0.73 | CHRM2 (0.58) | CHRM2CHRM3CHRM4CHRM1HDAC1 | |
| SCHEMBL19173796 | 0.73 | CHRM2 (0.58) | CHRM2CHRM3CHRM4CHRM1HDAC1 | |
| SCHEMBL28643439 | 0.72 | CHRM2 (1.00) | CHRM2CHRM3CHRM4CHRM1ALDH1A1 | |
| SCHEMBL29930459 | 0.72 | CHRM2 (1.00) | CHRM2CHRM3CHRM4CHRM1ALDH1A1 | |
| SCHEMBL20348513 | 0.72 | CHRM2 (0.56) | CHRM2CHRM3HDAC1HDAC6ALDH1A1 | |
| SCHEMBL30335825 | 0.72 | CHRM2 (0.56) | CHRM2CHRM3HDAC1HDAC6ALDH1A1 |
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-113527172-B | M2 acetylcholine receptor antagonists and uses thereof | 上海交通大学医学院附属仁济医院 | 2022-10-25 | — | — | CN | disclosed |