Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 15/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.37 |
| ▸ | DPP7 | Q9UHL4 | 5/20 | 0.37 |
| ▸ | DPP8 | Q6V1X1 | 4/20 | 0.37 |
| ▸ | DPP9 | Q86TI2 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL3453798 | 1.00 | DPP4 (0.50) | DPP4KCNH2SLC7A5DPP7DPP8 | |
| SCHEMBL28055243 | 0.83 | DPP4 (0.49) | DPP4KCNH2SLC7A5DPP7DPP8 | |
| SCHEMBL27899116 | 0.83 | DPP4 (0.49) | DPP4KCNH2SLC7A5DPP7DPP8 | |
| SCHEMBL4002665 | 0.83 | CTSS (0.48) | DPP4SLC7A5 | |
| SCHEMBL11221173 | 0.83 | DPP4 (0.49) | DPP4KCNH2SLC7A5DPP7DPP8 | |
| SCHEMBL1519636 | 0.82 | SLC7A5 (0.43) | DPP4SLC7A5DPP7DPP8CYP2D6 | |
| SCHEMBL28304222 | 0.81 | DPP4 (0.51) | DPP4KCNH2DPP7DPP8DPP9 | |
| SCHEMBL1519830 | 0.77 | CTSS (0.46) | SLC7A5 | |
| SCHEMBL2897783 | 0.75 | IDO1 (0.44) | CYP3A4 | |
| SCHEMBL1521462 | 0.75 | IDO1 (0.44) | CYP3A4 |
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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116554060-A | Preparation method of Boc- (R) -3-amino-4- (2, 4, 5-trifluorophenyl) butyric acid | 江苏八巨药业有限公司 | 2023-08-08 | — | — | CN | claimed |
| CN-112500316-B | Method for preparing BOC- (R) -3-amino-4- (2,4,5-trifluorophenyl) butyric acid | 浙江永太手心医药科技有限公司 | 2022-11-08 | — | — | CN | claimed |
| CN-113979896-A | Sitagliptin impurity I and preparation method thereof | 浙江永太手心医药科技有限公司 | 2022-01-28 | — | — | CN | claimed |
| CN-109824546-B | BOC- (R) -3-amino-4- (2,4, 5-trifluorophenyl) butyric acid condensation impurity and preparation method thereof | 浙江永太科技股份有限公司 | 2021-07-02 | — | — | CN | claimed |
| CN-112500316-A | Method for preparing BOC- (R) -3-amino-4- (2,4, 5-trifluorophenyl) butyric acid | 浙江永太手心医药科技有限公司 | 2021-03-16 | — | — | CN | claimed |
| CN-112195201-A | Application of stereoselective transaminase in asymmetric synthesis of chiral amine | 弈柯莱生物科技(上海)股份有限公司 | 2021-01-08 | — | — | CN | claimed |
| US-20200157587-A1 | USE OFSTEREOSELECTIVE TRANSAMINASE IN ASYMMETRIC SYNTHESIS OF CHIRAL AMINE | Abiochem Biotechnology (Group) Co., Ltd. (CN) | 2020-05-21 | — | — | US | claimed |
| EP-3650537-A1 | USE OF STEREOSELECTIVE TRANSAMINASE IN ASYMMETRIC SYNTHESIS OF CHIRAL AMINE | Abiochem Biotechnology Co., Ltd. (CN) | 2020-05-13 | — | — | EP | claimed |
| CN-111057061-A | Preparation method of tert-butoxycarbonyl-sitagliptin | 台州保灵药业有限公司 | 2020-04-24 | — | — | CN | claimed |
| CN-110914417-A | Application of stereoselective transaminase in asymmetric synthesis of chiral amine | 上海弈柯莱生物医药科技有限公司 | 2020-03-24 | — | — | CN | claimed |
| 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 | claimed |
| CN-107286164-A | Purposes of the compound in sitagliptin is prepared and the method for preparing sitagliptin | 武汉臻智生物科技有限公司 | 2017-10-24 | — | — | CN | claimed |
| US-11965193-B2 | Use of stereoselective transaminase in asymmetric synthesis of chiral amine | ABIOCHEM BIOTECHNOLOGY CO., LTD (CN) | 2024-04-23 | — | — | US | disclosed |
| CN-117843643-A | Preparation method of sitagliptin phosphate | 北京诺康达医药科技股份有限公司 | 2024-04-09 | — | — | CN | disclosed |
| CN-111039900-B | Preparation method of 1-morpholine-4- (2, 4, 5-trifluoro-phenyl) butane-1, 3-dione | 弈柯莱生物科技(集团)股份有限公司 | 2023-12-22 | — | — | CN | disclosed |
| CN-116554060-A | Preparation method of Boc- (R) -3-amino-4- (2, 4, 5-trifluorophenyl) butyric acid | 江苏八巨药业有限公司 | 2023-08-08 | — | — | CN | disclosed |
| CN-107286164-A | Purposes of the compound in sitagliptin is prepared and the method for preparing sitagliptin | 武汉臻智生物科技有限公司 | 2017-10-24 | — | — | CN | disclosed |
| CN-104016993-B | A kind of compound suppressing DPP-IV and intermediate thereof | 成都先导药物开发有限公司 | 2016-09-07 | — | — | CN | disclosed |
| CN-103772323-B | DPP-4 inhibitor compound | NANJING HUAWE MEDICAL SCIENCE & TECHNOLOGY DEVELOPMENT CO., LTD. (CN) | 2015-08-05 | — | — | CN | disclosed |
| CN-103772323-A | DPP-4 (Dipepitidyl Peptidase-4) inhibitor compound | NANJING HUAWE MEDICAL TECHNOLOGY DEV CO LTD | 2014-05-07 | — | — | CN | disclosed |