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 | |
|---|---|---|---|---|
| Water SCHEMBL28269621 | 1.00 | — | — | |
| Water SCHEMBL16468522 | 0.87 | — | — | |
| Water SCHEMBL29611399 | 0.87 | — | — | |
| Water SCHEMBL28279663 | 0.87 | — | — | |
| Water SCHEMBL29287365 | 0.87 | — | — | |
| Water SCHEMBL29020520 | 0.87 | — | — | |
| Water SCHEMBL29168457 | 0.87 | — | — | |
| Water SCHEMBL29014310 | 0.87 | — | — | |
| Water SCHEMBL28742665 | 0.87 | — | — | |
| Water SCHEMBL28304034 | 0.87 | — | — |
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 169 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118693260-A | Composite coated lithium transition metal oxide material and preparation method and application thereof | 广东邦普循环科技有限公司 | 2024-09-24 | — | — | CN | claimed |
| CN-112374548-A | Method for treating high-iron material containing nickel-cobalt-manganese hydroxide | 宜宾光原锂电材料有限公司 | 2021-02-19 | — | — | CN | claimed |
| CN-110311127-A | A kind of preparation method of the high Ni-monocrystal tertiary cathode material of core-shell structure | 江苏翔鹰新能源科技有限公司 | 2019-10-08 | — | — | CN | claimed |
| CN-106784870-B | A kind of lithium-air battery non-carbon anode and preparation method thereof, lithium-air battery | 深圳大学 | 2019-08-30 | — | — | CN | claimed |
| CN-109473645-A | A kind of zinc cobalt-manganese ternary spinelle/N doping redox graphene composite material and preparation method | 江苏大学 | 2019-03-15 | — | — | CN | claimed |
| CN-108520952-A | A kind of nickelic electrode material and preparation method thereof with inorganic nanometer-powder bluk recombination | 广东迈纳科技有限公司 | 2018-09-11 | — | — | CN | claimed |
| CN-108269992-A | A kind of composite anode material of high-capacity lithium ion battery and preparation method thereof | 北京当升材料科技股份有限公司 | 2018-07-10 | — | — | CN | claimed |
| CN-106011911-B | A kind of method that partial vulcanization improves metal hydroxides analysis oxygen electrode performance | 重庆大学 | 2018-04-17 | — | — | CN | claimed |
| CN-107640792-A | A kind of high compact small particle nickel cobalt manganese hydroxide and preparation method thereof | 中南大学 | 2018-01-30 | — | — | CN | claimed |
| CN-107394160-A | Lithium ion battery anode material and preparation method thereof | 合肥国轩高科动力能源有限公司 | 2017-11-24 | — | — | CN | claimed |
| CN-106784870-A | A kind of lithium-air battery non-carbon positive pole and preparation method thereof, lithium-air battery | 深圳大学 | 2017-05-31 | — | — | CN | claimed |
| CN-106011911-A | Method of partial vulcanization to improve oxygen evolution electrode performance of metal hydroxide | 重庆大学 | 2016-10-12 | — | — | CN | claimed |
| CN-102544469-B | Nickel cobalt manganese hydroxide-coated doped spherical nickel oxyhydroxide and preparation method thereof | Henan kelong group co ltd | 2015-03-11 | — | — | CN | claimed |
| CN-104201367-A | High-density small-particle-size nickel-cobalt-manganese hydroxide and preparing method thereof | NINGXIA ORIENT TANTALUM IND CO | 2014-12-10 | — | — | CN | claimed |
| CN-121422995-A | Preparation of MnCo by phosphate modified precursor2O4Method and application of catalyst | 宁夏大学 | 2026-01-30 | — | — | CN | disclosed |
| CN-119601646-B | Modified ternary material and preparation method and application thereof | 天津国安盟固利新材料科技股份有限公司 | 2025-05-27 | — | — | CN | disclosed |
| US-20250137139-A1 | METAL COMPOUND THIN FILM, METHOD OF FORMING THE SAME AND THIN FLIM CATALYST FOR WATER ELECTROLYSIS | NATIONAL SUN YAT-SEN UNIVERSITY (TW) | 2025-05-01 | — | — | US | disclosed |
| EP-1667948-A1 | TITANIA SUPPORTS FOR FISCHER-TROPSCH CATALYSTS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 2006-06-14 | — | — | EP | disclosed |
| WO-2006048424-A1 | TITANIA SUPPORTS AND CATALYSTS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2006-05-11 | — | — | WO | disclosed |
| WO-2005030680-A1 | TITANIA SUPPORTS FOR FISHER-TROPSCH CATALYSTS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2005-04-07 | — | — | WO | disclosed |