Water

Water

SCHEMBL1796121

C1CON1.C1CON1.O

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
SCHEMBL275983 0.94
SCHEMBL28648053 0.89
Bromide SCHEMBL9512767 0.89
Hydrochloric Acid SCHEMBL2357424 0.89
SCHEMBL6570160 0.74 TSHR (0.36)
SCHEMBL733311 0.74
SCHEMBL916800 0.74
SCHEMBL25183744 0.71
Bromide SCHEMBL8837155 0.71
Cyclopropane SCHEMBL11497951 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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117987132-A Salt-resistant vegetable gum fracturing fluid 中国石油化工股份有限公司 2024-05-07 CN claimed
CN-117304911-A Bio-based fracturing fluid, preparation method and application thereof 中国石油化工股份有限公司 2023-12-29 CN claimed
CN-117285919-A Biological fracturing fluid for reservoir protection and preparation method thereof 中国石油化工股份有限公司 2023-12-26 CN claimed
CN-114181683-B Hydrophobic surface modified nano plugging agent and fracturing fluid containing same 中国石油化工股份有限公司 2023-03-31 CN claimed
CN-115126461-A Composite fracturing method for continental shale oil reservoir 中石化石油工程技术服务有限公司 2022-09-30 CN claimed
CN-114181683-A Hydrophobic surface modified nano plugging agent and fracturing fluid containing same 中国石油化工股份有限公司 2022-03-15 CN claimed
CN-109438629-B Super early strength polycarboxylate superplasticizer and preparation method thereof 岳阳东方雨虹防水技术有限责任公司 2021-10-15 CN claimed
CN-117987132-A Salt-resistant vegetable gum fracturing fluid 中国石油化工股份有限公司 2024-05-07 CN disclosed
CN-117304911-A Bio-based fracturing fluid, preparation method and application thereof 中国石油化工股份有限公司 2023-12-29 CN disclosed
CN-117285920-A Synthetic fracturing fluid for reservoir protection and preparation method thereof 中国石油化工股份有限公司 2023-12-26 CN disclosed
CN-117285919-A Biological fracturing fluid for reservoir protection and preparation method thereof 中国石油化工股份有限公司 2023-12-26 CN disclosed
CN-117285921-A Synthetic base fracturing fluid, preparation method and application thereof 中国石油化工股份有限公司 2023-12-26 CN disclosed
CN-114181683-B Hydrophobic surface modified nano plugging agent and fracturing fluid containing same 中国石油化工股份有限公司 2023-03-31 CN disclosed
CN-109438629-B Super early strength polycarboxylate superplasticizer and preparation method thereof 岳阳东方雨虹防水技术有限责任公司 2021-10-15 CN disclosed
CN-110540621-A Polycarboxylate superplasticizer for prefabricated concrete structure and preparation method thereof GUANGZHOU INST BUILDING SCIENCE CO LTD 2019-12-06 CN disclosed
US-10297461-B2 CMP polishing agent, manufacturing method thereof, and method for polishing substrate SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-05-21 US disclosed
US-10246620-B2 CMP polishing agent, method for manufacturing thereof, and method for polishing substrate SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-04-02 US disclosed
US-20170278718-A1 CMP POLISHING AGENT, MANUFACTURING METHOD THEREOF, AND METHOD FOR POLISHING SUBSTRATE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-09-28 US disclosed
US-20170037290-A1 CMP POLISHING AGENT, METHOD FOR MANUFACTURING THEREOF, AND METHOD FOR POLISHING SUBSTRATE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-02-09 US disclosed
US-20110124195-A1 Chemical Mechanical Polishing Composition Containing Polysilicon Polish Finisher TECHNO SEMICHEM CO., LTD. (KR) 2011-05-26 US disclosed