Water

Water

SCHEMBL194819

O.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Zn+2]

nearest known ligand 0.67

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.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
CA5A P35218 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
TSHR P16473 3/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
HPGD P15428 1/20 0.36
HIF1A Q16665 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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 SCHEMBL9150589 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL4375705 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL15068042 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL719719 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL2025101 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL4378846 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL1653807 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL7264813 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL60878 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL22204649 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025224744-A1 POLYMER ELECTROLYTE COMPOSITION FOR TAILORING CATHODE/ ELECTROLYTE INTERFACE IN QUASI-SOLID STATE METAL BATTERIES COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2025-10-30 WO claimed
US-20250297983-A1 METHOD FOR MANUFACTURING PALM TRUNK-LIKE HIERARCHICAL NANOSTRUCTURE AND PALM TRUNK-LIKE HIERARCHICAL NANOSTRUCTURE MANUFACTURED THEREBY PUKYONG NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2025-09-25 US claimed
CN-119506891-A Corrosion inhibitor based on metal organic framework and preparation method and application thereof 蚌埠学院 2025-02-25 CN claimed
CN-118851692-A Phase-change heat storage building block and sunlight greenhouse 北京锦绣新技术发展有限公司 2024-10-29 CN claimed
WO-2024205529-A1 STYRENE BLOCK COPOLYMER BASED SELF-HEALING THERMOPLASTIC ELASTOMERS AND THE PRODUCTION METHOD THEREOF ISTANBUL UNIVERSITESI - CERRAHPASA REKTORLUGU (TR) 2024-10-03 WO claimed
CN-118388780-A GO-ZIF-8 anti-ultraviolet antibacterial composite material and preparation method of master batch thereof 浙江桐昆新材料研究院有限公司 2024-07-26 CN claimed
CN-116328730-B Flexible metal organic framework material and preparation method and application thereof 上海科技大学 2024-07-26 CN claimed
CN-113680219-B Preparation method of MOF mixed matrix film for synchronous in-situ growth of phase inversion 浙江工业大学 2024-06-11 CN claimed
CN-117772251-A Pd-based porous biochar catalyst and preparation method and application thereof 江苏扬农化工集团有限公司 2024-03-29 CN claimed
CN-114308094-B Cobalt monoatomic/nitrogen doped mesoporous carbon fiber material, and preparation method and application thereof 中国石油大学(北京) 2023-09-29 CN claimed
CN-107362789-B Porous carbon modified ZnO photocatalytic material and preparation method thereof 武汉理工大学 2020-05-05 CN claimed
CN-111013622-A Z-type graphitized carbon nitride/carbon/sulfur-doped graphitized carbon nitride composite material and preparation method thereof 中国石油大学(北京) 2020-04-17 CN claimed
CN-110938045-A Broad-spectrum bactericidal pollution-free growth-promoting compound and composition thereof 刘力 2020-03-31 CN claimed
US-20140329079-A1 FIRE RESISTANT COMPOSITE STRUCTURE DOW GLOBAL TECHNOLOGIES LLC (US) 2014-11-06 US claimed
EP-2797739-A1 FIRE RESISTANT COMPOSITE STRUCTURE Dow Global Technologies LLC (US) 2014-11-05 EP claimed
CN-102584010-B Preparation method of multi-component aerogel UNIV HENAN TECHNOLOGY 2014-04-30 CN claimed
US-8614452-B2 Light-emitting diode having zinc oxide nanorods and method of fabricating the same GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-12-24 US claimed
WO-2013098859-A1 FIRE RESISTANT COMPOSITE STRUCTURE DOW GLOBAL TECHNOLOGIES LLC (US) 2013-07-04 WO claimed
CN-102584010-A Preparation method of multi-component aerogel UNIV HENAN TECHNOLOGY 2012-07-18 CN claimed
US-20110260191-A1 LIGHT-EMITTING DIODE HAVING ZINC OXIDE NANORODS AND METHOD OF FABRICATING THE SAME GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2011-10-27 US claimed