Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.41 |
| ▸ | CES1 | P23141 | 4/20 | 0.41 |
| ▸ | PSEN1 | P49768 | 5/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 5/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 5/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 5/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 5/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 5/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | CA3 | P07451 | 1/20 | 0.31 |
| ▸ | CA6 | P23280 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27655951 | 0.78 | HDAC3 (0.36) | — | |
| SCHEMBL28038735 | 0.77 | CES2 (0.35) | CES2CES1PSEN1PSEN2APH1B | |
| SCHEMBL27995445 | 0.70 | CES2 (0.43) | CES2CES1PSEN1PSEN2APH1B | |
| SCHEMBL27719617 | 0.68 | L3MBTL1 (0.41) | — | |
| SCHEMBL17102138 | 0.68 | CES2 (0.50) | CES2CES1PPARGCA3CA6 | |
| SCHEMBL27723959 | 0.68 | AURKA (0.33) | SMN1; SMN2 | |
| SCHEMBL27953658 | 0.67 | CES2 (0.46) | CES2CES1PSEN1PSEN2APH1B | |
| SCHEMBL28299886 | 0.67 | TYR (0.44) | — | |
| SCHEMBL21250530 | 0.66 | CES2 (0.49) | CES2CES1PSEN1PSEN2APH1B | |
| SCHEMBL14270122 | 0.64 | HTR2C (0.45) | CES2CES1PSEN1PSEN2APH1B |
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-105392772-B | Preparation method of key intermediate of augustine | 意大利合成制造有限公司 | 2017-09-15 | — | — | CN | disclosed |
| CN-105392772-A | Preparation method of key intermediate of augustine | FIS FABBRICA ITALIANA SINTETICI SPA | 2016-03-09 | — | — | CN | disclosed |