Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | CCKBR | P32239 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 3/20 | 0.43 |
| ▸ | PPARA | Q07869 | 3/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.43 |
| ▸ | CHRNG | P07510 | 1/20 | 0.43 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.43 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 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 | |
|---|---|---|---|---|
| SCHEMBL28528396 | 0.91 | ALDH1A1 (0.58) | CTSLALDH1A1MAPTHPGDKDM4E | |
| SCHEMBL2583795 | 0.91 | ALDH1A1 (0.58) | CTSLALDH1A1MAPTHPGDKDM4E | |
| SCHEMBL4521097 | 0.90 | CTSL (0.52) | CTSLALDH1A1MAPTHPGDKDM4E | |
| SCHEMBL4521105 | 0.90 | CTSL (0.52) | CTSLALDH1A1MAPTHPGDKDM4E | |
| SCHEMBL28285330 | 0.88 | CTNNB1 (0.45) | ALDH1A1MAPTHPGDKDM4EGAA | |
| SCHEMBL28285332 | 0.88 | CTNNB1 (0.45) | ALDH1A1MAPTHPGDKDM4EGAA | |
| SCHEMBL28285500 | 0.87 | CTSS (0.48) | ALDH1A1MAPTPPARGPPARAKLK5 | |
| SCHEMBL5522848 | 0.87 | CTSS (0.48) | ALDH1A1MAPTPPARGPPARAKLK5 | |
| SCHEMBL31479840 | 0.87 | CTSS (0.48) | ALDH1A1MAPTPPARGPPARAKLK5 | |
| SCHEMBL31134350 | 0.86 | ALDH1A1 (0.61) | ALDH1A1MAPTHPGDKDM4EGAA |
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-109476639-A | Pyrrolidin derivatives | 橘生药品工业股份有限公司 | 2019-03-15 | — | — | CN | disclosed |