Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.58 |
| ▸ | LMNA | P02545 | 3/20 | 0.58 |
| ▸ | TTR | P02766 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | SCN1A | P35498 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 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 | |
|---|---|---|---|---|
| Pentane SCHEMBL27681570 | 1.00 | — | — | |
| Dioxane SCHEMBL1463561 | 0.96 | TSHR (0.54) | TSHRLMNATTRTHRBSMN1; SMN2 | |
| Tetradecane SCHEMBL28284620 | 0.93 | TSHR (0.57) | TSHRLMNATTRTHRBEPHX1 | |
| Decane SCHEMBL4618626 | 0.93 | TSHR (0.57) | TSHRLMNATTRTHRBEPHX1 | |
| Heptane SCHEMBL1803195 | 0.93 | TSHR (0.57) | TSHRLMNATTRTHRBEPHX1 | |
| Nonane SCHEMBL27725295 | 0.93 | TSHR (0.57) | TSHRLMNATTRTHRBEPHX1 | |
| Dioxane SCHEMBL29286326 | 0.93 | TSHR (0.57) | TSHRLMNATTRTHRBEPHX1 | |
| Hexane SCHEMBL5207457 | 0.92 | — | — | |
| Oxirane SCHEMBL28436205 | 0.88 | TSHR (0.61) | TSHRLMNATHRBEPHX1ALDH1A1 | |
| Octane SCHEMBL28172325 | 0.88 | TSHR (0.61) | TSHRLMNATHRBEPHX1ALDH1A1 |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021129799-A1 | INFLUENZA VIRUS REPLICATION INHIBITOR AND USE THEREOF | 广东东阳光药业有限公司 | 2021-07-01 | — | — | WO | claimed |
| CN-105849096-B | Piperidine derivatives having multimodal activity against pain | 埃斯蒂文制药股份有限公司 | 2019-11-29 | — | — | CN | claimed |
| CN-108290856-A | Aryl-substituted dihydroquinolones, their preparation and their use as medicaments | 尼奥迈德研究所 | 2018-07-17 | — | — | CN | claimed |
| CN-106232735-B | Dispersible pigment dispersion and its purposes and graft type silicone polymer | 富士胶片株式会社 | 2019-07-19 | — | — | CN | disclosed |
| CN-108289931-A | The nucleoside reverse transcriptase inhibitors of 4 '-substitutions and its preparation | 默沙东公司 | 2018-07-17 | — | — | CN | disclosed |
| CN-105308054-B | substituted thiazole and pyrimidine | 拜耳制药股份公司 | 2017-11-21 | — | — | CN | disclosed |
| CN-103492395-B | Catalyst composition comprising transition metal complex with thiolate ligand | 切弗朗菲利浦化学公司 | 2017-07-11 | — | — | CN | disclosed |
| CN-106928080-A | Fused rings γ amino acid derivativges and preparation method thereof and in application pharmaceutically | 四川海思科制药有限公司 | 2017-07-07 | — | — | CN | disclosed |
| CN-104684899-B | Substituted sulfonamide compounds | 霍夫曼-拉罗奇有限公司 | 2017-07-04 | — | — | CN | disclosed |
| CN-106232735-A | The transfer materials of dispersible pigment dispersion, decoration material, decoration material formation, the base material of band decoration material, touch screen, information display device, graft type silicone polymer | 富士胶片株式会社 | 2016-12-14 | — | — | CN | disclosed |
| CN-1307154-C | Photochemical synthesis of vitamin D2Method (2) | CHINESE ACAD TECH INST PHYSICS (CN) | 2007-03-28 | — | — | CN | disclosed |
| CN-1733718-A | Photochemical synthesis of vitamin D2Method (2) | CHINESE ACAD TECH INST PHYSICS (CN) | 2006-02-15 | — | — | CN | disclosed |
| WO-2004111003-A1 | AMIDE DERIVATIVES AS SELECTIVE SEROTONIN RE-UPTAKE INHIBITORS | PFIZER LIMITED (GB) | 2004-12-23 | — | — | WO | disclosed |