Water

Water

SCHEMBL383056

Cl[Rh].O

nearest known ligand 0.00

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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 SCHEMBL3253722 1.00
Water SCHEMBL28493031 1.00
Water SCHEMBL2290666 0.87
Water SCHEMBL29401311 0.82
SCHEMBL106287 0.82
SCHEMBL21200329 0.82
Water SCHEMBL29797588 0.78
Water SCHEMBL29797630 0.78
Water SCHEMBL29797826 0.78
Ammonia Solution, Strong SCHEMBL1069295 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120115163-A Three-functional amorphous/crystalline Rh (OH)3/NiMoO4Preparation method and application of heterojunction electrolyzed water catalyst 昆明理工大学 2025-06-10 CN claimed
CN-119571376-A Preparation method for preparing single-atom electrocatalyst on surface of current collector in situ 苏州行则兴氢能源科技有限公司 2025-03-07 CN claimed
CN-119465275-A Three-dimensional net Rh/Ni (OH)2Preparation method and application of nanowire composite material 江苏大学 2025-02-18 CN claimed
EP-3464173-B1 CATALYST FOR LOW TEMPERATURE ETHANOL STEAM REFORMING AND RELATED PROCESS KT KINETICS TECH S P A (IT) 2024-08-07 EP claimed
CN-117800821-A Method and catalyst for preparing chiral alpha-aryl propanal through asymmetric hydroformylation 青岛科技大学 2024-04-02 CN claimed
CN-117797812-A Rhodium-ruthenium bimetallic catalyst and preparation method and application thereof 天津大学 2024-04-02 CN claimed
CN-117772193-A Preparation method of metal/cerium oxide single-atom catalyst 河南师范大学 2024-03-29 CN claimed
CN-117699846-A Fluorine doped tin dioxide and preparation method thereof, catalyst and preparation method and application thereof 嘉庚创新实验室 2024-03-15 CN claimed
CN-117181219-A Rhodium-silicon catalyst and preparation method and application thereof 天津大学 2023-12-08 CN claimed
CN-116836052-A Preparation method of rhodium (II) octoate dimer 贵研化学材料(云南)有限公司 2023-10-03 CN claimed
CN-113583245-B Hyperbranched poly (benzoic acid ester) and preparation method and application thereof 苏州大学 2023-03-21 CN claimed
CN-115651030-A Method for synthesizing acetylacetonatocarbonyltriphenylphosphine rhodium by one-pot method 四川大学 2023-01-31 CN claimed
US-11167268-B2 Catalyst and method for manufacturing the same and method for hydrogenating aromatic epoxy compound NATIONAL TSING HUA UNIVERSITY (TW) 2021-11-09 US claimed
CN-113583245-A Hyperbranched poly (benzoic acid ester) and preparation method and application thereof 苏州大学 2021-11-02 CN claimed
US-20210086167-A1 Catalyst and Method for Manufacturing the Same and Method for Hydrogenating Aromatic Epoxy Compound NATIONAL TSING HUA UNIVERSITY (TW) 2021-03-25 US claimed
CN-111020210-A Method for recovering rhodium from waste homogeneous rhodium catalyst 浙江省冶金研究院有限公司 2020-04-17 CN claimed
US-20190127220-A1 CATALYST FOR LOW TEMPERATURE ETHANOL STEAM REFORMING AND RELATED PROCESS KT - KINETICS TECHNOLOGY S.P.A. (IT) 2019-05-02 US claimed
EP-3464173-A1 CATALYST FOR LOW TEMPERATURE ETHANOL STEAM REFORMING AND RELATED PROCESS KT - Kinetics Technology S.p.A. (IT) 2019-04-10 EP claimed
CN-104086351-B A kind of method of acetylene hydrochlorination preparing chloroethylene taking nitrogen heterocyclic protonic acid ionic liquid as medium 浙江大学 2016-06-08 CN claimed
CN-101172987-A Method for producing 3-(triphenylphosphine )-carbonyl hydrogenation Rh CHINA PETROLEUM CHEM CO LTD (CN) 2008-05-07 CN claimed