Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR6 | P46095 | 3/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | RYR2 | Q92736 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 3/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | CCR6 | P51684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28076593 | 0.87 | HTR1A (0.45) | GPR6RYR2HTR1ASLC6A4 | |
| SCHEMBL28076775 | 0.81 | HTR1A (0.43) | GPR6RYR2HTR1ASLC6A4 | |
| SCHEMBL28076638 | 0.77 | HTR1A (0.46) | RYR2HTR1ASLC6A4 | |
| SCHEMBL28076772 | 0.75 | HTR1A (0.43) | GPR6HTR1ASLC6A4 | |
| SCHEMBL3577962 | 0.74 | RYR2 (0.49) | RYR2SIGMAR1HTR1ASLC6A4 | |
| SCHEMBL30323089 | 0.72 | GPR6 (0.59) | GPR6HTR1ASLC6A4 | |
| SCHEMBL20524624 | 0.72 | GPR6 (0.59) | GPR6HTR1ASLC6A4 | |
| SCHEMBL3586208 | 0.71 | MEN1 (0.43) | RYR2HTR1ASLC6A4 | |
| SCHEMBL3587135 | 0.70 | PIK3CG (0.52) | RYR2HTR1ASLC6A4 | |
| SCHEMBL3574540 | 0.70 | MTNR1A (0.44) | RYR2HTR1ASLC6A4 |
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-103980184-B | Piperidine compounds, medical composition and its use containing this compound | 爱思开生物制药株式会社 | 2016-08-24 | — | — | CN | disclosed |