Water

Water

SCHEMBL492907

O.O.[Se]

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 SCHEMBL492910 1.00
Water SCHEMBL4404981 1.00
Hydrochloric Acid SCHEMBL23360803 0.82
Water SCHEMBL30729235 0.82
Water SCHEMBL821217 0.82
Selenium SCHEMBL14987 0.71
Water SCHEMBL20338157 0.71
Water SCHEMBL15484266 0.71
Water SCHEMBL2121635 0.71
SCHEMBL9235412 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3294310-B1 A HIGHLY CONCENTRATED POWDERED OLEORESIN COMPOSITION AND PROCESS FOR PREPARATION THEREOF PARACHUR VIVEK ANAND (IN) 2025-08-13 EP claimed
CN-117626802-B Expansion type bridge cable fireproof wrapping belt and manufacturing and installing methods 中交公路长大桥建设国家工程研究中心有限公司 2024-08-16 CN claimed
CN-118486507-A 1E-level fire-resistant cable for nuclear facilities 新亚特电缆股份有限公司 2024-08-13 CN claimed
CN-117626802-A Expansion type bridge cable fireproof wrapping belt and manufacturing and installing methods 中交公路长大桥建设国家工程研究中心有限公司 2024-03-01 CN claimed
US-10792252-B2 Highly concentrated powdered oleoresin composition and process for preparation thereof Parachur, Vivek Anand (IN) 2020-10-06 US claimed
CN-109337372-A A kind of fire-proof sealing material of Underground Rail Transit and preparation method thereof 江苏海龙核科技股份有限公司 2019-02-15 CN claimed
US-20180289622-A1 A HIGHLY CONCENTRATED POWDERED OLEORESIN COMPOSITION AND PROCESS FOR PREPARATION THEREOF PARACHUR VIVEK ANAND (IN) 2018-10-11 US claimed
CN-108366974-A Trimolecular complexes of natural compounds 维韦克·阿南德·帕拉库尔 2018-08-03 CN claimed
CN-105343941-B A kind of surface modification biological Nickel-titanium alloy for medical purpose and its preparation method and application 中国科学院上海硅酸盐研究所 2018-06-22 CN claimed
CN-106750947-A A kind of novel environment friendly anti-electrostatic fire retardant cable material 安徽天元电缆有限公司 2017-05-31 CN claimed
CN-104726018-A Preparation method of environment-friendly double-component high-temperature-resisting fireproof coating ENTC NUCLEAR MATERIALS TECHNOLOGY JIANGSU CO LTD 2015-06-24 CN claimed
CN-104726020-A Nuclear-grade high-temperature-resistance fireproof coating and preparation method thereof ENTC NUCLEAR MATERIALS TECHNOLOGY JIANGSU CO LTD 2015-06-24 CN claimed
CN-104292838-A Room temperature vulcanized fireproof elastomer plate and preparation method thereof ENTC NUCLEAR MATERIALS TECHNOLOGY JIANGSU CO LTD 2015-01-21 CN claimed
US-8911857-B2 Vascular stents AXETIS AG (CH) 2014-12-16 US claimed
CN-102741458-A Electrochemical method of producing copper indium gallium diselenide (cigs) solar cells UNIV WESTERN ONTARIO 2012-10-17 CN claimed
US-20120130482-A1 VASCULAR STENTS AXETIS AG (CH) 2012-05-24 US claimed
US-8105374-B2 Vascular stents AXETIS AG (CH) 2012-01-31 US claimed
US-20070100438-A1 Vascular stents CIVELLI, CARLO (SG) 2007-05-03 US claimed
US-6207190-B1 SYNERGISTIC MIXTURE TO REDUCE OCULAR PRESSURE AND IMPROVE VASCULAR HEALTH COMPRISING FOLIC ACID, A MAGNESIUM SALT, ALPHA-TOCOPHEROL, ASCORBATE AND ALPHA-LIPOIC ACID CHRONORX, LLC 2001-03-27 US claimed
US-4038377-A REMOVAL OF SELENIUM FROM URETHANE SOLUTIONS ATLANTIC RICHFIELD COMPANY (US) 1977-07-26 US claimed