Known targets — ChEMBL curated mechanism
GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ
The experimentally established mechanism targets of Water. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Lithium Ion SCHEMBL28302580 | 0.82 | — | — | |
| Water SCHEMBL27862678 | 0.82 | — | — | |
| Water SCHEMBL27951031 | 0.82 | — | — | |
| Water SCHEMBL27876469 | 0.71 | — | — | |
| SCHEMBL29484461 | 0.71 | — | — | |
| SCHEMBL8840579 | 0.71 | — | — | |
| SCHEMBL798394 | 0.71 | — | — | |
| Water SCHEMBL23501481 | 0.50 | — | — | |
| Water SCHEMBL21058326 | 0.50 | — | — | |
| Lithium Ion SCHEMBL8675018 | 0.50 | CYP3A4 (0.33) | — |
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 362 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-121573701-A | Rare earth hydroxide micro-nano material with rough surface, and preparation method and application thereof | 复旦大学 | 2026-02-27 | — | — | CN | claimed |
| CN-115260015-B | Method for producing methacrolein and methacrylic acid | 中国石油化工股份有限公司 | 2025-05-06 | — | — | CN | claimed |
| CN-118877921-A | Layered rare earth hydroxide nanotube cone fluorescent material and preparation method and application thereof | 重庆理工大学 | 2024-11-01 | — | — | CN | claimed |
| CN-118461042-A | Hydrogen evolution catalyst, preparation method and application | 上海氢阅科技有限公司 | 2024-08-09 | — | — | CN | claimed |
| CN-115260015-A | Method for preparing methacrolein and methacrylic acid | 中国石油化工股份有限公司 | 2022-11-01 | — | — | CN | claimed |
| CN-113387563-B | Praseodymium-doped red light glass and preparation method thereof | 包头稀土研究院 | 2022-03-18 | — | — | CN | claimed |
| CN-112811458-B | Mesoporous rare earth hydroxide nano material and preparation method thereof | 复旦大学 | 2021-11-19 | — | — | CN | claimed |
| CN-113387563-A | Praseodymium-doped red light glass and preparation method thereof | 包头稀土研究院 | 2021-09-14 | — | — | CN | claimed |
| CN-112811458-A | Mesoporous rare earth hydroxide nano material and preparation method thereof | 复旦大学 | 2021-05-18 | — | — | CN | claimed |
| CN-112387276-A | Supported ruthenium cluster catalyst for ammonia synthesis and preparation method and application thereof | 中国科学院大连化学物理研究所 | 2021-02-23 | — | — | CN | claimed |
| CN-101624206-A | Preparation method and application of rare earth metal hydroxide or vanadate nano material | UNIV NANKAI | 2010-01-13 | — | — | CN | claimed |
| CN-101475202-A | Rare earth solution precipitating agent production process using calcium oxide | RIPING HUANG (CN) | 2009-07-08 | — | — | CN | claimed |
| CN-101219379-A | Palladium-on-carbon base nano-catalyst for producing hydrogen gas by direct decomposition of methanoic acid and method for producing the same | CHANGCHUN APPLIED CHEMISTRY (CN) | 2008-07-16 | — | — | CN | claimed |
| CN-101177612-A | Praseodymium doped red long-afterglow luminescent material and preparation method thereof | BAOTOU RARE EARTH RES INST (CN) | 2008-05-14 | — | — | CN | claimed |
| CN-101012500-A | Method for fully separating high-purity rare earth oxide from low-yttrium medium-heavy rare earth ore | CHANGZHOU HUANAN CHEMICAL INDU (CN) | 2007-08-08 | — | — | CN | claimed |
| CN-101012501-A | Method for fully separating high-purity rare earth oxide from yttrium-rich rare earth ore | JINTAN XINAN CHEMICAL INDUSTRY (CN) | 2007-08-08 | — | — | CN | claimed |
| CN-1201351-C | Aluminium electrolytic capacitor and its producing mehtod | MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) | 2005-05-11 | — | — | CN | claimed |
| CN-1327245-A | Aluminium electrolytic capacitor and its producing mehtod | MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) | 2001-12-19 | — | — | CN | claimed |
| US-5250478-A | Including sintering aid of ytterbium oxide and/or erbium oxide; density; heat conductivity | KYOCERA CORPORATION (JP) | 1993-10-05 | — | — | US | claimed |
| US-4211882-A | OXIDIZING P-TOLUALDEHYDE, CATALYST CONSISTING OF A MANGANESE COMPOUND, A COBALT COMPOUND, A BROMINE COMPOUND, AND A NICKEL, IRON, CHROMIUM, OR LANTHANIDE COMPOUND | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1980-07-08 | — | — | US | claimed |