Water

Water

SCHEMBL2147482

O.O.[Ti].[Zn]

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 SCHEMBL5799737 1.00
Water SCHEMBL8522670 0.87
Water SCHEMBL9447199 0.87
Water SCHEMBL30959700 0.87
Water SCHEMBL23927966 0.87
Water SCHEMBL23151877 0.87
Water SCHEMBL22551320 0.87
Water SCHEMBL22372627 0.87
Water SCHEMBL20554933 0.87
Water SCHEMBL27312184 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114106665-B High-wear-resistance strong-corrosion-resistance nano composite material coating and preparation method thereof 哈尔滨工业大学 2022-11-18 CN claimed
CN-114106665-A High-wear-resistance strong-corrosion-resistance nano composite material coating and preparation method thereof 哈尔滨工业大学 2022-03-01 CN claimed
CN-110637070-B Packaging adhesive film for solar cell and preparation method and application thereof 苏州赛伍应用技术股份有限公司 2021-12-07 CN claimed
CN-113290891-A Production and processing method of PVC (polyvinyl chloride) buckle plate 东莞市哈克电子科技有限公司 2021-08-24 CN claimed
CN-108148517-B Packaging adhesive film for solar cell and preparation method and application thereof 苏州赛伍应用技术股份有限公司 2021-01-08 CN claimed
CN-110637070-A Packaging adhesive film for solar cell and preparation method and application thereof 苏州赛伍应用技术股份有限公司 2019-12-31 CN claimed
CN-109735317-A A kind of preparation method and bringing device of oil well neutral de-plugging agent 西安石油大油气科技有限公司 2019-05-10 CN claimed
CN-109705320-A A kind of method and polyester functional agglomerate of continuous production of polyesters functional agglomerate 中国纺织科学研究院有限公司 2019-05-03 CN claimed
CN-109504115-A A kind of antimicrobial form PE plastic formula 李壮深 2019-03-22 CN claimed
CN-109265857-A A kind of safe environment protection type PVC buckle and its processing method 蚌埠市鑫晟新材料科技有限公司 2019-01-25 CN claimed
CN-105176325-A Acid and alkali resistant flame retardation and antibiosis coating WANG LU 2015-12-23 CN claimed
CN-105131285-A Synthetic method of light-transmitting polyimide electronic packaging material UNIV TAIYUAN TECHNOLOGY 2015-12-09 CN claimed
CN-105017963-A Anticorrosive paint HUZHOU DAZHOU HIGH MOLECULAR MATERIAL CO LTD 2015-11-04 CN claimed
CN-104923207-A Surface modification method for titanium dioxide mingled with zinc UNIV CHANGZHOU 2015-09-23 CN claimed
CN-104548216-A Capculorhexis forceps CHANGSHU HENRY MEDICAL INSTR CO LTD 2015-04-29 CN claimed
CN-104473675-A Medical bending separating forceps CHANGSHU HENRY MEDICAL INSTR CO LTD 2015-04-01 CN claimed
CN-102079906-A Silver-zinc titanium dioxide antibacterial paint JUAN ZHANG 2011-06-01 CN claimed
CN-100521943-C Inorganic/organic nano composite antibacterial agent and its fabric product application BEIJING CHAMGO NANO TECH CO LT (CN) 2009-08-05 CN claimed
CN-101411337-A Composite anti-bacteria agent, antibiotic paint and antibiotic aluminum composite board GUANGZHOU WILLSTRONG NEW MATER (CN) 2009-04-22 CN claimed
CN-101189971-A Inorganic/organic nano composite antibacterial agent and its fabric product application BEIJING CHAMGO NANO TECH CO LT (CN) 2008-06-04 CN claimed