Water

Water

SCHEMBL486758

O.[CaH2].[CaH2]

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

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 SCHEMBL9489446 1.00
Water SCHEMBL457728 1.00
Water SCHEMBL9136338 1.00
Water SCHEMBL8332252 1.00
Water SCHEMBL5193902 1.00
Water SCHEMBL409681 1.00
Water SCHEMBL5595444 1.00
Water SCHEMBL570871 1.00
Water SCHEMBL8664030 1.00
Water SCHEMBL10626151 1.00

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025202071-A1 METHOD OF PROCESSING GYPSUM SAINT-GOBAIN PLACO (FR) 2025-10-02 WO claimed
EP-4624437-A1 METHOD OF PROCESSING GYPSUM SAINT-GOBAIN PLACO (FR) 2025-10-01 EP claimed
CN-119371948-A Thermosetting resin composition for well cementation and preparation method thereof 中国石油天然气集团有限公司 2025-01-28 CN claimed
EP-3700967-B1 SPRAY DRYING METHOD BASF SE (DE) 2024-04-03 EP claimed
CN-114684837-B Recycling device and method for preparing active calcium oxide from calcium carbide slag as calcium carbide raw material 内蒙古亿利化学工业有限公司 2023-12-22 CN claimed
EP-3077335-B1 PROCESS FOR THE PRODUCTION OF A SOURCE OF PHOSPHATE FOR AGRICULTURE AND FOOD INDUSTRY PRAYON (BE) 2023-10-11 EP claimed
EP-4059904-B1 A PROCESS FOR THE CONTINUOUS PREPARATION OF ALPHA-CALCIUM SULPHATE HEMIHYDRATE SAINT GOBAIN PLACO (FR) 2023-09-06 EP claimed
EP-3646894-B1 IMPLANT, PREFERABLY FOR TREATING A BONE AND / OR CARTILAGE DEFECT AESCULAP AG (DE) 2023-05-10 EP claimed
CN-115849736-A Device for preparing active calcium oxide calcium carbide raw material from calcium carbide slag 安徽华塑股份有限公司 2023-03-28 CN claimed
CN-112358736-B Water-resistant salt-resistant thermosetting resin gel composition and preparation method thereof 中国石油天然气集团有限公司 2023-03-21 CN claimed
EP-0169842-A1 METHOD FOR THE PREPARATION OF PHOSPHORIC ACID AND CALCIUM SULPHATE. PRAYON SOC (BE) 1986-02-05 EP claimed
EP-0021682-B1 CEMENTITIOUS PRODUCT IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-09-25 EP claimed
EP-0077373-B1 TREATING CALCINED GYPSUM WITH SOLUBILIZING AGENT UNITED STATES GYPSUM COMPANY (US) 1985-07-31 EP claimed
EP-0063232-B1 SELF-LEVELLING MORTAR COMPOSITION Gebr. Knauf Westdeutsche Gipswerke (DE) 1984-11-14 EP claimed
WO-1984003690-A1 METHOD FOR THE PREPARATION OF PHOSPHORIC ACID AND CALCIUM SULPHATE PRAYON SOC (BE) 1984-09-27 WO claimed
EP-0045619-B1 PROCESS FOR SETTING A LATEX OF A FILM FORMING POLYMER The British Petroleum Company p.l.c. (GB) 1984-04-04 EP claimed
EP-0022624-B1 PROCESS FOR SETTING A POLYCHLOROPRENE-LATEX The British Petroleum Company p.l.c. (GB) 1984-01-18 EP claimed
EP-0013108-B1 IMPROVEMENTS IN AND RELATING TO GRANULATION Adelaide & Wallaroo Fertilizers Ltd. (AU) 1983-11-23 EP claimed
EP-0009176-B1 PROCESS FOR PREPARING AQUEOUS CALCIUM SULFATE HEMIHYDRATE SUSPENSIONS AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1982-03-10 EP claimed
EP-0001205-B1 FLOOR HEATING SYSTEM HOECHST AKTIENGESELLSCHAFT (DE) 1981-09-23 EP claimed