Water

Water

SCHEMBL136879

O.O.O.O.O.O.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Fe+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 SCHEMBL22260994 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL434244 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL7672700 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL60726 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL6019667 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL16178480 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL29126608 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL20507993 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL28800951 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL21182365 0.94 MEN1 (0.75) 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 2686 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122081993-A Preparation method of high-efficiency stable industrial grade OER nickel-iron catalyst 2026-05-26 CN claimed
CN-122076489-A Iron single-atom composite catalyst with double-layer carbon-nitrogen shell structure and application thereof 2026-05-26 CN claimed
CN-121379932-B Culture medium for high-density serum-free suspension culture of BHK-21 cells and application thereof Zhongsheng tianxinhe (Wuxi) Biotechnology Co.,Ltd. (CN) 2026-05-26 CN claimed
CN-122076478-A High-entropy metaphosphate catalyst and preparation method and application thereof 2026-05-26 CN claimed
CN-118105977-B Bionic siliconizing enhanced catalyst and preparation method and application thereof SICHUAN UNIVERSITY (CN) 2026-05-26 CN claimed
US-20260139354-A1 METHODS OF IMPROVING ELECTRODES FOR LIQUID ALKALINE WATER ELECTROLYZERS THE REGENTS OF THE UNIV OF CALIFORNIA (US) 2026-05-21 US claimed
WO-2026106023-A1 MANGANESE OXIDE CATALYST SUBSTITUTED WITH TRANSITION METAL, METHOD FOR MANUFACTURING SAME, AND OXYGEN EVOLUTION REACTION USING SAME 서울시립대학교 산학협력단 2026-05-21 WO claimed
US-20260008690-A1 METHOD FOR SYNTHESIZING DYSPROSIUM-DOPED COPPER-ZINC FERRITE NANOMATERIALS AND A HUMIDITY SENSING SYSTEM THEREOF Princess Nourah Bint Abdulrahman University (SA) 2026-01-08 US claimed
US-12435005-B1 Fe2TiO5/Fe1.766O3/TiO2/CoFe2O4/C nanocomposite and method of preparation thereof IMAM MOHAMMAD IBN SAUD ISLAMIC UNIVERSITY (SA) 2025-10-07 US claimed
US-20250257291-A1 PARTICULATE LAUNDRY SCENT ADDITIVE COMPRISING A PERFUME/WATER-SOLUBLE POLYMER/SALT HYDRATE MATRIX PROCTER & GAMBLE (US) 2025-08-14 US claimed
CN-1377331-A Catalyst composition and process for preparing the same PHILLIPS PETROLEUM CO (US) 2002-10-30 CN claimed
EP-1230025-A1 PROCESS FOR PRODUCING A METAL ALUMINATE CATALYST SUPPORT Philips Petroleum Company (US) 2002-08-14 EP claimed
US-20020107424-A1 Hydrocarbon hydrogenation catalyst and process CHEUNG TIN-TACK PETER (US) 2002-08-08 US claimed
US-6417136-B2 METAL ALUMINATE SUPPORT WITH PALLADIUM AND A SILVER OR ALKALI METAL CATALYST COMPONENT; SUPPORT IS PREPARED BY CALCINING A MIXTURE OF ALUMINA AND A MELTED METAL COMPONENT PHILLIPS PETROLEUM COMPANY 2002-07-09 US claimed
EP-1218322-A1 CATALYST COMPOSITION AND PROCESS FOR MAKING THE COMPOSITION Phillips Petroleum Company (US) 2002-07-03 EP claimed
US-6369000-B1 IMPREGNATING ALUMINA WITH A MELTED METAL COMPOUND, CALCINING, DOES NOT INVOLVE PHYSICAL MIXING OR COPRECIPITATION PHILLIPS PETROLEUM COMPANY 2002-04-09 US claimed
US-20010046943-A1 HYDROCARBON HYDROGENATION CATALYST AND PROCESS CHEVRON PHILLIPS CHEMICAL COMPANY LP 2001-11-29 US claimed
WO-2001019763-A1 CATALYST COMPOSITION AND PROCESS FOR MAKING THE COMPOSITION PHILLIPS PETROLEUM COMPANY (US) 2001-03-22 WO claimed
WO-2001019514-A1 PROCESS FOR PRODUCING A METAL ALUMINATE CATALYST SUPPORT PHILIPS PETROLEUM COMPANY (US) 2001-03-22 WO claimed
US-5788990-A Water-repellent powder and manufacture of the same DOW CORNING TORAY SILICONE CO., LTD. (JP) 1998-08-04 US claimed