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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1664798 | 0.87 | — | — | |
| Water SCHEMBL27708883 | 0.87 | — | — | |
| Water SCHEMBL10659097 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL1665355 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL1664499 | 0.87 | — | — | |
| Water SCHEMBL27878283 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL4149865 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL1665256 | 0.87 | — | — | |
| Water SCHEMBL8050234 | 0.82 | — | — | |
| Water SCHEMBL11326285 | 0.82 | — | — |
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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116799175-A | Lithium zirconium chloride and lithium aluminum chloride double-coated graphite composite material and preparation method thereof | 晖阳(贵州)新能源材料有限公司 | 2023-09-22 | — | — | CN | claimed |
| CN-116632193-A | Lithium zirconium chloride and lithium aluminum chloride double-coated graphite composite material and preparation method thereof | 湖南拓森新能源有限公司 | 2023-08-22 | — | — | CN | claimed |
| CN-102294242-B | Hydrogenation catalyst before carbon dioxide and preparation method thereof | PETROCHINA CO LTD | 2014-04-02 | — | — | CN | claimed |
| CN-102247896-B | Alumina-zirconia composite carrier and preparation method thereof | PETROCHINA CO LTD | 2013-02-13 | — | — | CN | claimed |
| CN-102294242-A | Hydrogenation catalyst before carbon dioxide and preparation method thereof | — | 2011-12-28 | — | — | CN | claimed |
| CN-102247896-A | Alumina-zirconia composite carrier and preparation method thereof | PETROCHINA CO LTD | 2011-11-23 | — | — | CN | claimed |
| CN-1247055-A | Face-care compsns. containing pigment and anti-sweat agent, and application of same composns. | OREAL (FR) | 2000-03-15 | — | — | CN | claimed |
| CN-1246327-A | Cosmetic composite containing pigment, anti-sweat agent and partial cross-linked solid elastic organic polyorganosiloxane and use of the composite | OREAL (FR) | 2000-03-08 | — | — | CN | claimed |
| CN-119768149-A | Personal care compositions, methods of using such compositions, and methods of improving their dispersibility, stability, and deposition effectiveness | 巴斯夫欧洲公司 | 2025-04-04 | — | — | CN | disclosed |
| CN-119303600-A | N-alkane isomerization catalyst prepared from polyaluminium chloride | 润和催化材料(浙江)有限公司 | 2025-01-14 | — | — | CN | disclosed |
| CN-116799175-A | Lithium zirconium chloride and lithium aluminum chloride double-coated graphite composite material and preparation method thereof | 晖阳(贵州)新能源材料有限公司 | 2023-09-22 | — | — | CN | disclosed |
| CN-116799175-A | Lithium zirconium chloride and lithium aluminum chloride double-coated graphite composite material and preparation method thereof | 晖阳(贵州)新能源材料有限公司 | 2023-09-22 | — | — | CN | disclosed |
| CN-116632193-A | Lithium zirconium chloride and lithium aluminum chloride double-coated graphite composite material and preparation method thereof | 湖南拓森新能源有限公司 | 2023-08-22 | — | — | CN | disclosed |
| CN-116632193-A | Lithium zirconium chloride and lithium aluminum chloride double-coated graphite composite material and preparation method thereof | 湖南拓森新能源有限公司 | 2023-08-22 | — | — | CN | disclosed |
| CN-1865151-A | Nano compound oxide preparation method | CHINA PETROLEUM & CHEMICAL (CN) | 2006-11-22 | — | — | CN | disclosed |
| CN-1829765-A | Method for the agglomeration of fine superabsorber particles | STOCKHAUSEN CHEM FAB GMBH (DE) | 2006-09-06 | — | — | CN | disclosed |
| WO-2005099896-A1 | SOLIDE ACID CATALYST AND METHOD OF USING SAME | ABB LUMMUS GLOBAL, INC. (US) | 2005-10-27 | — | — | WO | disclosed |
| US-20050234283-A1 | Solid acid catalyst and method of using same | ABB LUMMUS GLOBAL, INC. | 2005-10-20 | — | — | US | disclosed |
| CN-1247055-A | Face-care compsns. containing pigment and anti-sweat agent, and application of same composns. | OREAL (FR) | 2000-03-15 | — | — | CN | disclosed |
| CN-1246327-A | Cosmetic composite containing pigment, anti-sweat agent and partial cross-linked solid elastic organic polyorganosiloxane and use of the composite | OREAL (FR) | 2000-03-08 | — | — | CN | disclosed |