Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 3/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | FAAH | O00519 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2798765 | 0.98 | GABRA1 (0.40) | GABRA1GABRG2GABRB3GABRB2TSHR | |
| SCHEMBL19810044 | 0.93 | DPP4 (0.39) | GABRA1GABRG2GABRB3GABRB2TSHR | |
| SCHEMBL19514082 | 0.93 | DPP4 (0.39) | GABRA1GABRG2GABRB3GABRB2TSHR | |
| SCHEMBL16267050 | 0.81 | GABRA1 (0.43) | GABRA1GABRG2GABRB3GABRB2TSHR | |
| SCHEMBL4216299 | 0.80 | DPP4 (0.41) | GABRA1GABRG2GABRB3GABRB2TSHR | |
| SCHEMBL16655509 | 0.79 | DPP4 (0.45) | GABRA1GABRG2GABRB3GABRB2TSHR | |
| SCHEMBL29445003 | 0.79 | GABRA1 (0.41) | GABRA1GABRG2GABRB3GABRB2TSHR | |
| SCHEMBL22320712 | 0.79 | GABRA1 (0.41) | GABRA1GABRG2GABRB3GABRB2TSHR | |
| SCHEMBL1821813 | 0.79 | GABRA1 (0.41) | GABRA1GABRG2GABRB3GABRB2TSHR | |
| SCHEMBL29042594 | 0.79 | GABRA1 (0.41) | GABRA1GABRG2GABRB3GABRB2TSHR |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118103021-A | Esters of 5-methylhex-2-enol and use thereof as fragrance chemicals | 巴斯夫欧洲公司 | 2024-05-28 | — | — | CN | claimed |
| CN-116390905-A | Intermolecular reaction of acetylene with 2-alkylfuran in the presence of gold (I) complex to form para-alkylphenol | 帝斯曼知识产权资产管理有限公司 | 2023-07-04 | — | — | CN | claimed |
| CN-115785104-A | Method for synthesizing spiro [ indoline-3, 3' -pyrrolidine ] derivative catalyzed by monovalent gold | 沈阳药科大学 | 2023-03-14 | — | — | CN | claimed |
| CN-115785087-A | Method for synthesizing 1H-pyrido [4,3-b ] indole skeleton compound catalyzed by monovalent gold | 沈阳药科大学 | 2023-03-14 | — | — | CN | claimed |
| CN-115772171-A | Method for synthesizing spiro [ indoline-3, 3' -piperidine ] skeleton under catalysis of monovalent gold | 沈阳药科大学 | 2023-03-10 | — | — | CN | claimed |
| WO-2020036243-A1 | METHOD FOR SYNTHESIZING THIENO[3,2-B]PYRIDINE-5(4H)-ONE DERIVATIVE COMPOUND, USING GOLD CATALYST, AND USE THEREFOR | 한국해양과학기술원 | 2020-02-20 | — | — | WO | claimed |
| EP-4396187-A1 | NAPHTHYRIDINE COMPOUNDS AS INHIBITORS OF KRAS | Incyte Corporation (US) | 2024-07-10 | — | — | EP | disclosed |
| CN-118103021-A | Esters of 5-methylhex-2-enol and use thereof as fragrance chemicals | 巴斯夫欧洲公司 | 2024-05-28 | — | — | CN | disclosed |
| CN-116390905-A | Intermolecular reaction of acetylene with 2-alkylfuran in the presence of gold (I) complex to form para-alkylphenol | 帝斯曼知识产权资产管理有限公司 | 2023-07-04 | — | — | CN | disclosed |
| CN-115785104-A | Method for synthesizing spiro [ indoline-3, 3' -pyrrolidine ] derivative catalyzed by monovalent gold | 沈阳药科大学 | 2023-03-14 | — | — | CN | disclosed |
| CN-115785087-A | Method for synthesizing 1H-pyrido [4,3-b ] indole skeleton compound catalyzed by monovalent gold | 沈阳药科大学 | 2023-03-14 | — | — | CN | disclosed |
| WO-2023034290-A1 | NAPHTHYRIDINE COMPOUNDS AS INHIBITORS OF KRAS | INCYTE CORPORATION (US) | 2023-03-09 | — | — | WO | disclosed |
| EP-4127162-A1 | MODIFIED DNA-ENCODED CHEMICAL LIBRARY AND METHODS RELATED THERETO | Technische Universität Dortmund (DE) | 2023-02-08 | — | — | EP | disclosed |
| CN-113498342-A | Compounds involved in synergistic binding and uses thereof | 锐新医药公司 | 2021-10-12 | — | — | CN | disclosed |
| CN-108929215-B | Synthesis method of cis-alpha-halogenated alpha, beta-unsaturated ketone compound | 浙江工业大学 | 2021-07-27 | — | — | CN | disclosed |
| CN-108863751-B | Synthetic method of Z-type halogenated chalcone compound | 浙江工业大学 | 2021-07-27 | — | — | CN | disclosed |
| WO-2020036243-A1 | METHOD FOR SYNTHESIZING THIENO[3,2-B]PYRIDINE-5(4H)-ONE DERIVATIVE COMPOUND, USING GOLD CATALYST, AND USE THEREFOR | 한국해양과학기술원 | 2020-02-20 | — | — | WO | disclosed |
| CN-108929215-A | A kind of synthetic method of the halogenated alpha, beta unsaturated ketone class compound of cis- α | 浙江工业大学 | 2018-12-04 | — | — | CN | disclosed |
| CN-108863751-A | A kind of synthetic method of the halogenated chalcone compounds of Z formula | 浙江工业大学 | 2018-11-23 | — | — | CN | disclosed |