Water

Water

SCHEMBL150200

CCC[N+](C)(CCC)CCC.[OH-]

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

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.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 3/20 0.47
DNM1 Q05193 11/20 0.38
APAF1 O14727 1/20 0.38
HSP90AA1 P07900 1/20 0.38
RAD52 P43351 1/20 0.38
HTT P42858 2/20 0.35
SLC22A2 O15244 1/20 0.33
LSS P48449 1/20 0.32
KMT2A Q03164 1/20 0.32

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL144694 0.96 SLC22A1 (0.50) SLC22A1DNM1HTTSLC22A2LSS
Iodide SCHEMBL237492 0.92 SLC22A1 (0.47) SLC22A1DNM1APAF1HSP90AA1RAD52
Hydrochloric Acid SCHEMBL240453 0.92 SLC22A1 (0.47) SLC22A1DNM1HSP90AA1RAD52HTT
Bromide SCHEMBL238492 0.92 SLC22A1 (0.47) SLC22A1DNM1HSP90AA1RAD52HTT
Fluoride Ion SCHEMBL4615667 0.92 SLC22A1 (0.47) SLC22A1DNM1APAF1HSP90AA1RAD52
Water SCHEMBL18549353 0.87 SLC22A1 (0.47) SLC22A1DNM1APAF1HSP90AA1RAD52
Water SCHEMBL19639224 0.85 SLC22A1 (0.41) SLC22A1DNM1APAF1HSP90AA1RAD52
Water SCHEMBL31503925 0.85 SLC22A1 (0.41) SLC22A1DNM1APAF1HSP90AA1RAD52
SCHEMBL3312353 0.82 SLC22A1 (0.50) SLC22A1DNM1HTTSLC22A2LSS
SCHEMBL6839718 0.82 SLC22A1 (0.39) SLC22A1DNM1HTTLSS

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 790 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119976882-A Method for synthesizing hierarchical pore molecular sieve 中国石油大学(华东) 2025-05-13 CN claimed
CN-112859549-B Developing solution for retarding AlN substrate corrosion 宁波南大光电材料有限公司 2025-02-21 CN claimed
CN-118814176-A Cleaning composition for chip after chemical mechanical polishing, preparation method and application thereof 浙江奥首材料科技有限公司 2024-10-22 CN claimed
CN-118771403-A Modified titanium-silicon molecular sieve, titanium-silicon molecular sieve supported metal nanoparticle catalyst, preparation method and propylene gas-phase epoxidation method 中国石油化工股份有限公司 2024-10-15 CN claimed
US-12054578-B2 Process for producing porous materials AEROGEL-IT GMBH (DE) 2024-08-06 US claimed
CN-118179577-A Alkali treatment-metal synergistic modified ZSM-5 molecular sieve catalyst 中国石油天然气股份有限公司 2024-06-14 CN claimed
CN-117772270-A Double-function catalyst for packaging Ni@H-MCM-22 molecular sieve and preparation method thereof 中国石油化工股份有限公司 2024-03-29 CN claimed
CN-117761977-A Corrosion-resistant alkaline developer 国科天骥(滨州)新材料有限责任公司 2024-03-26 CN claimed
CN-117170199-A Dry film stripping liquid and application thereof 芝普企业股份有限公司 2023-12-05 CN claimed
CN-110139829-B Polyaluminium salts and their use in the preparation of high purity colloidal aluminum-silica composite particles and zeolites 埃科莱布美国股份有限公司 2023-10-13 CN claimed
CN-1428659-A Stripping liquid for photoresist and photoresist stripping method using said stripping liguid TOKYO APPLIED CHEMICAL INDUSTR (JP) 2003-07-09 CN claimed
EP-1056686-A4 PROCESS FOR RECOVERING ONIUM HYDROXIDES FROM SOLUTIONS CONTAINING ONIUM COMPOUNDS SACHEM INC (US) 2001-11-14 EP claimed
US-6207039-B1 CHARGING SOLUTION CONTAINING ONIUM COMPOUND TO ELECTROCHEMICAL CELL COMPRISING AT LEAST TWO COMPARTMENTS, ONE COMPRISING ION EXCHANGE MATERIAL, CATHODE, ANODE, DIVIDER, PASSING CURRENT THROUGH CELL TO PRODUCE ONIUM SALT, RECOVERING SALT SACHEM, INC. 2001-03-27 US claimed
EP-1056686-A1 PROCESS FOR RECOVERING ONIUM HYDROXIDES FROM SOLUTIONS CONTAINING ONIUM COMPOUNDS Sachem, Inc. (US) 2000-12-06 EP claimed
EP-1027415-A1 CLEANING COMPOSITIONS AND METHODS FOR CLEANING RESIN AND POLYMERIC MATERIALS USED IN MANUFACTURE Kyzen Corporation (US) 2000-08-16 EP claimed
US-6054061-A HYDROGEN PEROXIDE, INORGANIC ACID, AN AMINE FREE OF A SURFACTANT GROUP A CORROSION INHIBITOR; TREATING A METAL SURFACE TO INCREASE ITS SURFACE ROUGHNESS FOR SUBSEQUENT ADHESION TO A POLYMER LAYER. SHIPLEY COMPANY, L.L.C. (US) 2000-04-25 US claimed
US-5968338-A Process for recovering onium hydroxides from solutions containing onium compounds SACHEM, INC. (US) 1999-10-19 US claimed
WO-1999051529-A1 PROCESS FOR RECOVERING ONIUM HYDROXIDES OR ONIUM SALTS FROM SOLUTIONS CONTAINING ONIUM COMPOUNDS USING ELECTROCHEMICAL ION EXCHANGE SACHEM, INC. (US) 1999-10-14 WO claimed
WO-1999036363-A1 PROCESS FOR RECOVERING ONIUM HYDROXIDES FROM SOLUTIONS CONTAINING ONIUM COMPOUNDS SACHEM, INC. (US) 1999-07-22 WO claimed
WO-1999016855-A1 CLEANING COMPOSITIONS AND METHODS FOR CLEANING RESIN AND POLYMERIC MATERIALS USED IN MANUFACTURE KYZEN CORPORATION (US) 1999-04-08 WO claimed