Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | BCL9 | O00512 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 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 | |
|---|---|---|---|---|
| SCHEMBL27915961 | 0.89 | KMT2A (0.50) | ALOX15KMT2AKDM4EMEN1RECQL | |
| SCHEMBL27789372 | 0.86 | ALOX15 (0.43) | ALOX15ALDH1A1BCL9CTNNB1KMT2A | |
| SCHEMBL10181392 | 0.85 | ALOX15 (0.45) | ALOX15KMT2AKDM4ERECQLLMNA | |
| SCHEMBL10179983 | 0.82 | ALOX15 (0.45) | ALOX15ALDH1A1BCL9CTNNB1KMT2A | |
| SCHEMBL2003095 | 0.81 | ALOX15 (0.51) | ALOX15BCL9CTNNB1KMT2AKDM4E | |
| SCHEMBL2001222 | 0.81 | ALOX15 (0.48) | ALOX15BCL9CTNNB1KMT2AKDM4E | |
| SCHEMBL27917198 | 0.80 | CYP4F2 (0.41) | ALDH1A1LMNACYP4F2CYP4A11RAB9A | |
| SCHEMBL6907595 | 0.80 | CYP4F2 (0.37) | ALDH1A1KMT2AKDM4EMEN1LMNA | |
| SCHEMBL2000685 | 0.79 | ALOX15 (0.41) | ALOX15ALDH1A1BCL9CTNNB1KMT2A | |
| SCHEMBL27579984 | 0.79 | ALOX15 (0.40) | ALOX15ALDH1A1BCL9CTNNB1KMT2A |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109896980-A | A kind of biological synthesis method of sitagliptin intermediate | 浙江九洲药业股份有限公司 | 2019-06-18 | — | — | CN | claimed |
| CN-105254519-B | Synthesizing method of sitagliptin key intermediate | 常州吉恩药业有限公司 | 2017-05-17 | — | — | CN | claimed |
| CN-109896980-A | A kind of biological synthesis method of sitagliptin intermediate | 浙江九洲药业股份有限公司 | 2019-06-18 | — | — | CN | disclosed |
| CN-109824546-A | BOC- (R) -3- amino -4- (2,4,5- trifluorophenyl) butyric acid is condensed impurity and preparation method thereof | 浙江永太科技股份有限公司 | 2019-05-31 | — | — | CN | disclosed |
| CN-109721555-A | Acylated piperazine class compound and application thereof | 广东东阳光药业有限公司 | 2019-05-07 | — | — | CN | disclosed |
| CN-105331651-B | The enzyme-chemically preparation method of sitagliptin and its intermediate | 尚科生物医药（上海）有限公司 | 2018-11-13 | — | — | CN | disclosed |
| CN-106478460-B | A kind of synthetic method of chirality N-Boc-3- amino -4- aryl-butyric acid | 衢州学院 | 2018-06-12 | — | — | CN | disclosed |
| CN-106478460-A | A kind of synthetic method of 3 amino of chirality N Boc, 4 aryl butyric acid | 衢州学院 | 2017-03-08 | — | — | CN | disclosed |
| CN-102574856-B | The synthesis of sitagliptin | 基因里克斯(英国)有限公司 | 2016-09-21 | — | — | CN | disclosed |
| CN-103483340-B | A kind of synthetic method of sitagliptin | 无锡佰翱得生物科学有限公司 | 2016-09-07 | — | — | CN | disclosed |
| CN-104159886-A | Preparation of optically pure beta-amino acid active pharmaceutical ingredients and intermediates thereof | LEK PHARMACEUTICALS | 2014-11-19 | — | — | CN | disclosed |
| CN-104112870-A | Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same | MITSUBISHI CHEM CORP | 2014-10-22 | — | — | CN | disclosed |
| US-20130244122-A1 | NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME | ONUKI MASAMICHI (JP) | 2013-09-19 | — | — | US | disclosed |
| US-20120219866-A1 | NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2012-08-30 | — | — | US | disclosed |
| EP-2475041-A1 | NON-AQUEOUS ELECTROLYTIC SOLUTION, AND NON-AQUEOUS ELECTROLYTE BATTERY COMPRISING SAME | Mitsubishi Chemical Corporation (JP) | 2012-07-11 | — | — | EP | disclosed |