Water

Water

SCHEMBL161891

O.O.O.[Rh]

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
Water SCHEMBL7205424 1.00
Water SCHEMBL28081725 1.00
Water SCHEMBL863777 1.00
Water SCHEMBL27943878 1.00
Water SCHEMBL7646361 1.00
Iodide SCHEMBL811216 0.82
Hydrochloric Acid SCHEMBL8911044 0.82 CA4 (0.33)
Hydrochloric Acid SCHEMBL441937 0.82
Bromide SCHEMBL7857756 0.82
Water SCHEMBL3152279 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4728107-A2 COMPOSITIONS, APPARATUS, SYSTEMS AND METHODS FOR EXTRACTING A METAL FROM AN AQUEOUS SOLUTION Energy Exploration Technologies, Inc. (US) 2026-04-22 EP claimed
WO-2025226865-A1 COMPOSITIONS, SYSTEMS AND METHODS FOR ADSORBING AT LEAST ONE METAL FROM A SOLUTION ENERGY EXPLORATION TECHNOLOGIES, INC. (US) 2025-10-30 WO claimed
CN-119541918-A Preparation method of simulated spent fuel 中国工程物理研究院核物理与化学研究所 2025-02-28 CN claimed
CN-119430181-A Catalytic conversion method for decomposing carbon dioxide into carbon monoxide 重庆大学 2025-02-14 CN claimed
WO-2024259209-A2 COMPOSITIONS, APPARATUS, SYSTEMS AND METHODS FOR EXTRACTING A METAL FROM AN AQUEOUS SOLUTION ENERGY EXPLORATION TECHNOLOGIES, INC. (US) 2024-12-19 WO claimed
CN-117983320-A Pre-activation method of supported metal catalyst, catalyst and application 中国科学院大连化学物理研究所 2024-05-07 CN claimed
CN-116060138-A Pre-activation method of supported metal catalyst, catalyst and application 中国科学院大连化学物理研究所 2023-05-05 CN claimed
CN-112441892-B Method and apparatus for separating liquid phase stream from mixed Ding Xiting hydroformylation reaction apparatus 中国石油化工股份有限公司 2023-03-14 CN claimed
CN-111320537-B Purification method of olefin hydroformylation product stream 中国海洋石油集团有限公司 2023-02-28 CN claimed
CN-111320538-B Method for separating liquid discharge of butene hydroformylation reaction 中国海洋石油集团有限公司 2023-02-28 CN claimed
CN-111195516-A Atomic-level monodisperse rhodium-based catalyst, preparation method thereof and application of atomic-level monodisperse rhodium-based catalyst in preparation of methyl acetate through methanol gas-phase carbonylation 中国科学院大连化学物理研究所 2020-05-26 CN claimed
CN-111195514-A Monoatomic dispersion rhodium-based catalyst, preparation method thereof and application thereof in methane low-temperature oxidation reaction 中国科学院大连化学物理研究所 2020-05-26 CN claimed
CN-110862307-A Method for preparing aldehyde by mixed carbon-four hydroformylation reaction 中国石油化工股份有限公司 2020-03-06 CN claimed
WO-2020020677-A1 METHOD FOR PRODUCING HYDROGENATED NITRILE RUBBER AND HNBR COMPOSITIONS THEREOF ARLANXEO DEUTSCHLAND GMBH (DE) 2020-01-30 WO claimed
EP-0998441-B1 METHOD FOR PRODUCING ALKANALS USING A RHODIUM-TRI-POLYETHYLENE GLYCOLATE CELANESE CHEM EUROPE GMBH (DE) 2002-12-11 EP claimed
US-6133477-A Preparation of 3-pentenoic acid E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-10-17 US claimed
EP-0701990-B1 Hydrocarbonylation of dimethyl ether AIR PROD & CHEM (US) 1999-03-10 EP claimed
EP-0578186-B1 Method for the preparation of 1-aza-2-silacyclopentane compounds DOW CORNING KK (JP) 1997-06-04 EP claimed
EP-0566370-B1 Integrated process for synthesizing oxygenated acetyl compounds from synthesis gas via dimethyl ether AIR PROD & CHEM (US) 1997-01-29 EP claimed
EP-0277824-B1 Process for acetic acid preparation and heterogeneous catalyst for same REILLY IND INC (US) 1994-04-27 EP claimed