Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | MITF | O75030 | 2/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27691495 | 0.75 | ALDH1A1 (0.51) | HSD11B1MAPTALDH1A1RAB9ANPC1 | |
| SCHEMBL3672572 | 0.75 | HSD11B1 (0.55) | HSD11B1MAPTMITFGSK3BALDH1A1 | |
| SCHEMBL199347 | 0.73 | CRHBP (0.62) | HSD11B1MAPTGSK3BALDH1A1RAB9A | |
| SCHEMBL593745 | 0.73 | MAPT (0.50) | MAPTGSK3BALDH1A1RAB9AKDM4E | |
| SCHEMBL14878603 | 0.72 | RAB9A (0.46) | MAPTALDH1A1RAB9AKDM4ENPC1 | |
| Hydrochloric Acid SCHEMBL28144703 | 0.71 | MAPT (0.48) | MAPTGSK3BALDH1A1RAB9AKDM4E | |
| Nitrobenzene SCHEMBL28016986 | 0.71 | ALDH1A1 (0.67) | MAPTALDH1A1RAB9ACES1CES2 | |
| SCHEMBL4319309 | 0.70 | CES2 (0.61) | HSD11B1MAPTMITFGSK3BALDH1A1 | |
| SCHEMBL8813717 | 0.70 | CES1 (0.45) | HSD11B1MAPTHTTMITFGSK3B | |
| SCHEMBL30846109 | 0.70 | GSK3B (0.48) | HSD11B1MAPTHTTMITFGSK3B |
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-109331868-A | A kind of phenylglycine class bifunctional catalysis' agent and its preparation method and application | 广东工业大学 | 2019-02-15 | — | — | CN | disclosed |