Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 14/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8523115 | 0.90 | ACHE (0.46) | ACHESLC6A4DRD2DRD1DRD4 | |
| SCHEMBL8513467 | 0.87 | ACHE (0.46) | ACHEDRD2DRD1DRD4BCHE | |
| SCHEMBL8522880 | 0.86 | ACHE (0.48) | ACHESLC6A4DRD2DRD1DRD4 | |
| SCHEMBL8512768 | 0.83 | GHSR (0.44) | ACHE | |
| SCHEMBL8513365 | 0.81 | ACHE (0.46) | ACHEDRD2DRD1DRD4BCHE | |
| SCHEMBL4002291 | 0.80 | ACHE (0.47) | ACHESLC6A4DRD2DRD1DRD4 | |
| SCHEMBL4010725 | 0.80 | ACHE (0.70) | ACHESLC6A4 | |
| Hydrochloric Acid SCHEMBL3865056 | 0.80 | ACHE (0.47) | ACHESLC6A4DRD2DRD1DRD4 | |
| Hydrochloric Acid SCHEMBL3868516 | 0.80 | ACHE (0.47) | ACHESLC6A4DRD2DRD1DRD4 | |
| Hydrochloric Acid SCHEMBL3862986 | 0.80 | ACHE (0.69) | ACHESLC6A4 |
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-2012065527-A1 | COMPOUDS AND USES AS L-TYPE CALCIUM CHANNEL BLOCKER AND/OR ACETYLCHOLINESTERASE INHIBITOR THEREOF | 江苏先声药物研究有限公司 (CN) | 2012-05-24 | — | — | WO | disclosed |