Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.44 |
| ▸ | CES1 | P23141 | 3/20 | 0.44 |
| ▸ | DCLRE1B | Q9H816 | 3/20 | 0.43 |
| ▸ | DCLRE1A | Q6PJP8 | 1/20 | 0.41 |
| ▸ | ALB | P02768 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 3/20 | 0.38 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.38 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28355672 | 0.79 | CES2 (0.45) | CES2CES1ALBBCHEMAP2K1 | |
| SCHEMBL2895115 | 0.79 | CES2 (0.45) | CES2CES1ALBBCHEMAP2K1 | |
| SCHEMBL2655336 | 0.79 | CES2 (0.45) | CES2CES1ALBBCHEMAP2K1 | |
| SCHEMBL27744 | 0.78 | CES2 (0.44) | CES2CES1ALBBCHEMAP2K1 | |
| SCHEMBL28494595 | 0.76 | CES2 (0.42) | CES2CES1ALBBCHEMAP2K1 | |
| SCHEMBL26363 | 0.75 | CES2 (0.41) | CES2CES1ALBBCHEMAP2K1 | |
| SCHEMBL29623861 | 0.75 | CES2 (0.38) | CES2CES1ALBBCHEMAP2K1 | |
| SCHEMBL20924693 | 0.75 | FFAR1 (0.44) | CES2CES1ALBALDH1A1ALOX15 | |
| SCHEMBL28602734 | 0.75 | CES2 (0.38) | CES2CES1ALBBCHEMAP2K1 | |
| SCHEMBL29027178 | 0.74 | ALDH1A1 (0.44) | CES2CES1ALDH1A1MAPT |
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-109504721-A | A kind of synthetic method of novel Tamiflu | 杭州科巢生物科技有限公司 | 2019-03-22 | — | — | CN | disclosed |