Water

Water

SCHEMBL72442

O.O.O.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[La+3]

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 SCHEMBL20393989 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL9151463 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL5067331 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL1900782 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL74669 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL12471279 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL6727854 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL10867031 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL5576323 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL10867036 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

Appears in 6858 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122076419-A Photocatalytic material for synchronously removing composite new pollutants in plateau lake and preparation method thereof 2026-05-26 CN claimed
CN-122091579-A High-capacity long-cycle lithium battery negative electrode material and preparation method thereof 2026-05-26 CN claimed
CN-122073953-A Nitrate modified titanium dioxide electron transport layer, perovskite solar cell and preparation method thereof 中国科学院上海硅酸盐研究所 2026-05-22 CN claimed
CN-122070996-A Method for preparing isobutyraldehyde by catalyzing methanol and ethanol with composite metal oxide catalyst 中国科学院大连化学物理研究所 2026-05-22 CN claimed
CN-122059631-A Preparation method of nonmagnetic ceramsite, low-magnetism concrete and preparation method thereof 上海建工建材科技集团股份有限公司 2026-05-19 CN claimed
CN-121758898-B MOF flame-retardant regenerated ABS composite material and preparation method thereof 湖南众科新材料有限公司 2026-05-19 CN claimed
CN-118059872-B Preparation method and application of binary oxide supported metal catalyst 中国科学院大连化学物理研究所 2026-05-15 CN claimed
CN-122038970-A Method for improving nitriding capacity of TC4 alloy by spin-coating rare earth element 安徽工业大学 2026-05-15 CN claimed
CN-122039411-A Preparation method and application of flexible high-emissivity coating on surface of continuous alumina fiber fabric 山东大学 2026-05-15 CN claimed
CN-122010572-A Graphene ceramic composite material and preparation method and application thereof 青岛百顿特种陶瓷技术有限公司 2026-05-12 CN claimed
CN-1385239-A Catalyst for catalytic purifying car tail gas and preparation process thereof SHANXI COAL CHEM INST (CN) 2002-12-18 CN claimed
CN-1304799-A Modified GaZSM-5 catalyst and its preparing process SHANXI COAL CHEM INST (CN) 2001-07-25 CN claimed
US-5939197-A COATING METAL WITH ORGANOMETALLIC AND ORGANOSILICON COMPOUNDS; COMPLEXING AND BONDING WITH MATRIX RESIN; CATALYTIC HYDROLYSIS USING ACETIC ACID THE BOEING COMPANY (US) 1999-08-17 US claimed
EP-0422105-B1 METAL OXIDE CERAMIC POWDERS AND METHODS OF MAKING SAME BATTELLE MEMORIAL INSTITUTE (US) 1994-09-07 EP claimed
US-5114702-A Method of making metal oxide ceramic powders by using a combustible amino acid compound BATTELLE MEMORIAL INSTITUTE (US) 1992-05-19 US claimed
EP-0422105-A4 METAL OXIDE CERAMIC POWDERS AND THIN FILMS AND METHODS OF MAKING SAME 1992-01-08 EP claimed
EP-0422105-A1 METAL OXIDE CERAMIC POWDERS AND METHODS OF MAKING SAME. BATTELLE MEMORIAL INSTITUTE (US) 1991-04-17 EP claimed
US-4962264-A ADDING RARE EARTH ELEMENTS OR COMPOUNDS BETZ LABORATORIES, INC. (US) 1990-10-09 US claimed
WO-1989012027-A1 METAL OXIDE CERAMIC POWDERS AND THIN FILMS AND METHODS OF MAKING SAME BATTELLE MEMORIAL INSTITUTE (US) 1989-12-14 WO claimed
CN-86103200-A Non-noble metal combustion catalyst and manufacture method thereof 1987-11-18 CN claimed