Water

Water

SCHEMBL11069842

[Ba+2].[Ca+2].[OH-].[OH-].[OH-].[OH-]

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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.

Compoundsimilaritytop predictedshared targets
Water SCHEMBL28233367 0.87
Water SCHEMBL4114559 0.82
Water SCHEMBL29152753 0.82
Water SCHEMBL1759 0.82
Water SCHEMBL7430 0.82
Water SCHEMBL27455594 0.82
Water SCHEMBL28097199 0.82
Water SCHEMBL6142606 0.82
Water SCHEMBL8143527 0.82
Water SCHEMBL25436825 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117224799-A Intelligent control method and early warning system of anesthesia respirator 南京舒普思达医疗设备有限公司 2023-12-15 CN claimed
US-20260144837-A1 GLP-1R AGONIST COMPOSITIONS AND METHODS OF USING JDS THERAPEUTICS, LLC (US) 2026-05-28 US disclosed
US-12622938-B2 Compositions and methods for modulating inflammatory response TURTLE BEAR HOLDINGS, LLC (US) 2026-05-12 US disclosed
US-12622940-B2 Combined fungal composition for modulating an inflammatory response TURTLE BEAR HOLDINGS, LLC (US) 2026-05-12 US disclosed
US-20260124163-A1 SOFT GUMMY OYSTERSHELL NV (BE) 2026-05-07 US disclosed
US-20260108544-A1 TRYPTAMINE COMPOSITIONS FOR ENHANCING NEURITE OUTGROWTH TURTLE BEAR HOLDINGS LLC (US) 2026-04-23 US disclosed
US-20260102416-A1 COMPOSITION OF MATTER FOR TREATING AT A MEDICAL CONDITION AND METHODS OF USE AND MANUFACTURE THEREOF TLCO HOLDINGS INC. (US) 2026-04-16 US disclosed
US-20260102338-A1 SOFT GUMMY OYSTERSHELL NV (BE) 2026-04-16 US disclosed
US-20260091130-A1 INJECTABLE FORMULATIONS OF PARP INHIBITORS AND USES THEREOF ZYMERON CORP (US) 2026-04-02 US disclosed
EP-4709378-A1 COMPOUNDS FOR NOS-RELATED CANCERS AND METHODS OF USE Yissum Research Development Company of the Hebrew University of Jerusalem Ltd. (IL) 2026-03-18 EP disclosed
CN-114377262-A Quantitative feeding device for anesthesia machine 吉林大学 2022-04-22 CN disclosed
US-11292791-B2 Tetrahydro-imidazo quinoline compositions as CBP/P300 inhibitors FORMA THERAPEUTICS, INC. (US) 2022-04-05 US disclosed
US-11287187-B2 Methods and systems for drying softgels with hydrophilic fills BARLEAN'S ORGANIC OILS, LLC (US) 2022-03-29 US disclosed
US-11279687-B2 Compounds and compositions for the inhibition of NAMPT VALO HEALTH, INC. (US) 2022-03-22 US disclosed
US-20220073452-A1 ALPHA-CINNAMIDE COMPOUNDS AND COMPOSITIONS AS HDAC8 INHIBITORS VALO HEALTH, INC. 2022-03-10 US disclosed
US-11267902-B2 Crystalline antibody formulations AMGEN INC. 2022-03-08 US disclosed
WO-2022046960-A1 COMPOSITION AND METHODS FOR TREATMENT OR PROPHYLAXIS OF CORONAVIRUS AND CANCERS BETAHEALTH, LLC (US) 2022-03-03 WO disclosed
US-20220062219-A1 COMPOSITION AND METHOD FOR TREATING OR PROPHYLAXIS OF CORONAVIRUS AND CANCERS BETAHEALTH, LLC 2022-03-03 US disclosed
EP-3946212-A1 METHODS AND SYSTEMS FOR DRYING SOFTGELS WITH HYDROPHILIC FILLS Barlean's Organic Oils, LLC (US) 2022-02-09 EP disclosed
US-4490294-A Pure salts of clavulanic acid, e.g. lithium clavulanate BEECHAM GROUP P.L.C. (GB) 1984-12-25 US disclosed