Water

Water

SCHEMBL1801747

O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Zr+4]

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 SCHEMBL9064828 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL1902538 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL27999023 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL17763247 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL29226893 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL2719910 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL651561 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL6032790 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL221658 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL2591140 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 155 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116688971-B Preparation method of solid catalyst and production method of biodiesel 齐鲁工业大学(山东省科学院) 2025-06-17 CN claimed
CN-119774633-A Conductive Y zeolite molecular sieve and preparation method and application thereof 西北工业大学 2025-04-08 CN claimed
CN-119406415-A Zirconium modified carbon coated copper-zinc catalyst, preparation and CO catalysis2Application of synthetic methanol 太原理工大学 2025-02-11 CN claimed
US-12151229-B1 Zirconium doped terbium nano oxides for wastewater remediation King Faisal University (SA) 2024-11-26 US claimed
CN-118571863-B Preparation method of alignment mark and semiconductor structure 合肥晶合集成电路股份有限公司 2024-11-12 CN claimed
CN-118571863-A Preparation method of alignment mark and semiconductor structure 合肥晶合集成电路股份有限公司 2024-08-30 CN claimed
CN-118477667-A High-activity high-selectivity CO2Co-based intermetallic carbide catalyst for preparing methanol by hydrogenation and preparation method and application thereof 浙江工业大学 2024-08-13 CN claimed
CN-118437315-A Non-noble metal propane dehydrogenation catalyst and preparation method and application thereof 北京科技大学 2024-08-06 CN claimed
CN-118125796-A Industrial preparation method of high-zirconium-oxygen composite polymer for high-speed airflow partition friction heat adhesion self-peeling composite material 安徽轩恒新材料科技有限公司 2024-06-04 CN claimed
CN-118047619-A Industrial method for rapidly preparing high-purity corundum crystal flame-retardant wadding and crystal flame-retardant board by adopting four-step method 安徽轩恒新材料科技有限公司 2024-05-17 CN claimed
WO-2023054785-A1 LOW-TEMPERATURE PREPARATION METHOD FOR INORGANIC NANOFIBER WEB 주식회사 레몬 2023-04-06 WO claimed
CN-115784867-A Method for preparing E-E sorbic acid by depolymerizing sorbic acid polyester under catalysis of solid acid 江苏润普食品科技股份有限公司 2023-03-14 CN claimed
WO-2022071597-A1 DENTAL CERAMIC COLORING SOLUTION クラレノリタケデンタル株式会社 2022-04-07 WO claimed
CN-114100627-A Method for preparing trimethylhydroquinone by trimethylbenzoquinone 上海工程技术大学 2022-03-01 CN claimed
US-11251463-B2 Method for preparing a sintered solid electrolyte having high ionic conductivity for an all-solid-state battery KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2022-02-15 US claimed
CN-113831525-A Preparation method of nonionic fatty alcohol polyether for defoaming agent 浙江皇马科技股份有限公司 2021-12-24 CN claimed
US-20190273283-A1 HIGH ION CONDUCTIVE SOLID ELECTROLYTE FOR ALL-SOLID STATE BATTERY AND METHOD FOR PREPARING SAME KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2019-09-05 US claimed
CN-108159843-A A kind of calcium base CO using zirconic acid calcium stable2Absorbent and preparation method thereof 清华大学 2018-06-15 CN claimed
CN-105521777-A A preparing method of a catalyst for low-temperature denitrification ANHUI YUANCHEN ENV PROTENTION SCIENCE AND TECH CO LTD 2016-04-27 CN claimed
US-20070179054-A1 EXHAUST GAS PURIFICATION CATALYST MAZDA MOTOR CORPORATION (JP) 2007-08-02 US claimed