Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL28153157 | 1.00 | CYP3A4 (0.44) | CYP3A4MAPTALDH1A1KCNH2SLC6A4 | |
| SCHEMBL28152039 | 0.81 | ALDH1A1 (0.43) | CYP3A4MAPTALDH1A1SLC6A4SLC6A3 | |
| SCHEMBL10217221 | 0.78 | MAPT (0.36) | CYP3A4MAPTALDH1A1KCNH2 | |
| SCHEMBL4736905 | 0.78 | MAPT (0.36) | CYP3A4MAPTALDH1A1KCNH2 | |
| SCHEMBL21159397 | 0.77 | OPRK1 (0.48) | ALDH1A1KCNH2SLC6A4 | |
| SCHEMBL29638013 | 0.77 | OPRK1 (0.48) | ALDH1A1KCNH2SLC6A4 | |
| SCHEMBL15934617 | 0.77 | OPRK1 (0.48) | ALDH1A1KCNH2SLC6A4 | |
| SCHEMBL29641090 | 0.77 | OPRK1 (0.48) | ALDH1A1KCNH2SLC6A4 | |
| SCHEMBL29641135 | 0.77 | OPRK1 (0.48) | ALDH1A1KCNH2SLC6A4 | |
| SCHEMBL9082047 | 0.77 | ALDH1A1 (0.37) | MAPTALDH1A1KCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106928127-B | Substituted piperidine amide derivative, preparation method and pharmaceutical application thereof | 四川海思科制药有限公司 | 2021-07-16 | — | — | CN | disclosed |
| CN-106928127-A | Substituted piperidine class amide derivatives and preparation method thereof and application pharmaceutically | 四川海思科制药有限公司 | 2017-07-07 | — | — | CN | disclosed |