Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.31 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.31 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | STAT6 | P42226 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.31 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6742682 | 0.83 | THRB (0.36) | THRBCYP2C9EPHX2EPHX1HSD11B1 | |
| SCHEMBL28396623 | 0.81 | THRB (0.32) | THRBCYP2C9EPHX2EPHX1HSD11B1 | |
| SCHEMBL2019240 | 0.81 | THRB (0.32) | THRBCYP2C9EPHX2EPHX1HSD11B1 | |
| SCHEMBL7734535 | 0.78 | EPHX1 (0.35) | THRBCYP2C9EPHX2EPHX1HSD11B1 | |
| SCHEMBL3929216 | 0.78 | ALDH1A1 (0.38) | THRBCYP2C9EPHX2EPHX1LMNA | |
| SCHEMBL27976720 | 0.71 | MAPK1 (0.42) | CYP2C9EPHX2HSD11B1 | |
| Bicarbonate SCHEMBL905261 | 0.69 | THRB (0.39) | THRBCYP2C9EPHX2EPHX1HSD11B1 | |
| SCHEMBL2746956 | 0.68 | THRB (0.38) | THRBCYP2C9EPHX2EPHX1HSD11B1 | |
| SCHEMBL28071496 | 0.67 | HSD17B10 (0.35) | EPHX2HSD11B1TSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL6879879 | 0.67 | GRM2 (0.35) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106191154-A | A kind of biological preparation method of onglyza intermediate (S) N tertbutyloxycarbonyl 3 hydroxyl 1 adamantyl D glycine | 江苏福瑞生物医药有限公司 | 2016-12-07 | — | — | CN | claimed |
| CN-105112469-B | The method that enzymatic asymmetry transamination prepares saxagliptin chiral intermediate | 福建省微生物研究所 | 2018-07-27 | — | — | CN | disclosed |
| CN-106191154-A | A kind of biological preparation method of onglyza intermediate (S) N tertbutyloxycarbonyl 3 hydroxyl 1 adamantyl D glycine | 江苏福瑞生物医药有限公司 | 2016-12-07 | — | — | CN | disclosed |
| CN-105112469-A | Method for preparing saxagliptin chiral intermediate through enzymatic-catalysis asymmetric transamination | FUJIAN INST MICROBIOLOGY | 2015-12-02 | — | — | CN | disclosed |
| EP-2611770-A1 | PROCESS FOR THE REDUCTIVE AMINATION OF -KETO CARBOXYLIC ACIDS | Sandoz AG (CH) | 2013-07-10 | — | — | EP | disclosed |
| WO-2012028721-A1 | PROCESS FOR THE REDUCTIVE AMINATION OF α-KETO CARBOXYLIC ACIDS | SANDOZ AG (CH) | 2012-03-08 | — | — | WO | disclosed |