Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | PNMT | P11086 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | PHGDH | O43175 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 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 | |
|---|---|---|---|---|
| SCHEMBL30724682 | 0.80 | HDAC8 (0.54) | GBA1NOS2HRH4HDAC8HDAC6 | |
| SCHEMBL30724688 | 0.79 | GBA1 (0.47) | GBA1PRMT5HDAC8HDAC6ADRA2A | |
| SCHEMBL30724695 | 0.75 | HDAC8 (0.50) | GBA1HDAC8HDAC6KDM4EADRA2A | |
| SCHEMBL27195343 | 0.74 | SORT1 (0.42) | GBA1PRMT5HDAC8HDAC6 | |
| SCHEMBL30724674 | 0.74 | SORT1 (0.42) | GBA1PRMT5HDAC8HDAC6 | |
| SCHEMBL24112178 | 0.71 | MAPK1 (0.39) | GBA1PRMT5HDAC8HDAC6MCHR1 | |
| SCHEMBL24112177 | 0.71 | MAPK1 (0.39) | GBA1PRMT5HDAC8HDAC6MCHR1 | |
| SCHEMBL30724683 | 0.71 | HDAC8 (0.41) | GBA1HDAC8HDAC6ADRA2APNMT | |
| SCHEMBL24613289 | 0.70 | PNMT (0.44) | GBA1PRMT5ADRA2APNMTADRA2B | |
| SCHEMBL3576035 | 0.70 | NOS1 (0.52) | NOS1NOS2HRH4KDM4EALDH1A1 |
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-117396471-A | Novel piperidine derivatives and pharmaceutical compositions for inhibiting autotaxin comprising the same | 株式会社次代生物科学 | 2024-01-12 | — | — | CN | disclosed |