Water

Water

SCHEMBL1469112

O.O.O.[Ce].[Ce].[Zr]

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 SCHEMBL2673298 1.00
Water SCHEMBL27875864 1.00
Water SCHEMBL5269674 1.00
Water SCHEMBL4164214 1.00
Water SCHEMBL2585033 1.00
Water SCHEMBL27587797 0.87
Water SCHEMBL28009587 0.87
Water SCHEMBL28101369 0.87
Water SCHEMBL1599688 0.87
Water SCHEMBL27736166 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111491731-B Ternary catalyst for purifying waste gas N.E.化学株式会社 2023-11-10 CN claimed
CN-112573570-A Scandium-cerium-doped zirconium oxide superfine powder and preparation method thereof 广东先导稀材股份有限公司 2021-03-30 CN claimed
CN-111491731-A Three-way catalyst for exhaust gas purification N.E.化学株式会社 2020-08-04 CN claimed
CN-105517704-B Exhaust gas purifying catalyst for motor vehicle 丰田自动车株式会社 2019-01-04 CN claimed
CN-106745169-A A kind of bigger serface mesoporous cerium oxide zirconium solid solution and preparation method thereof 上海应用技术大学 2017-05-31 CN claimed
CN-105517704-A Exhaust gas purifying catalyst for motor vehicle TOYOTA MOTOR CORP 2016-04-20 CN claimed
CN-103406136-B Preparation method of honeycomb ceramic net through Lu and N co-doped TiO2 photocatalysis JIANGSU GAOCHUN CERAMICS IND CO LTD 2014-12-17 CN claimed
CN-103406136-A Preparation method of honeycomb ceramic net through Lu and N co-doped TiO2 photocatalysis Jiangsu gaochun ceramics industry co ltd 2013-11-27 CN claimed
CN-103038175-A Cerium oxide-zirconium oxide-based composite oxide, method for producing same, and catalyst for exhaust gas purification using same TOYODA CHUO KENKYUSHO KK 2013-04-10 CN claimed
CN-101096012-B Cerium oxide-zirconium oxide-based mixed oxide and method for producing thereof DAIICHI KIGENSOKAGAKU KOGYO CO 2013-01-02 CN claimed
CN-102781840-A Cerium oxide-zirconium oxide composite oxide and method for producing the same DAIICHI KIGENSO KAGAKU KOGYO 2012-11-14 CN claimed
EP-1872851-B1 Cerium oxide-zirconium oxide-based mixed oxide and method for the production thereof DAIICHI KIGENSO KAGAKU KOGYO (JP) 2012-08-01 EP claimed
US-8048389-B2 Cerium oxide-zirconium oxide-based mixed oxide and method for producing thereof DAIICHI KIGENSO KAGAKU KOGYO CO., LTD. (JP) 2011-11-01 US claimed
US-20110071017-A1 CERIUM OXIDE-ZIRCONIUM OXIDE-BASED MIXED OXIDE AND METHOD FOR PRODUCING THEREOF DAIICHI KIGENSO KAGAKU KOGYO CO., LTD. (JP) 2011-03-24 US claimed
CN-100475688-C Metal oxides produced by flame spray pyrolysis EIDGENOESS TECH HOCHSCHULE (CH) 2009-04-08 CN claimed
US-20080009410-A1 Cerium oxide-zirconium oxide-based mixed oxide and method for producing the same DAIICHI KIGENSO KAGAKU KOGYO CO., LTD. (JP) 2008-01-10 US claimed
EP-1872851-A2 Cerium oxide-zirconium oxide-based mixed oxide and methode for producing thereof Daiichi Kigenso Kagaku Co., Ltd. (JP) 2008-01-02 EP claimed
CN-114797468-B Exhaust gas purification system 丰田自动车株式会社 2024-06-21 CN disclosed
CN-1665743-A Metal oxides prepared by flame spray pyrolysis EIDGENOESS TECH HOCHSCHULE (CH) 2005-09-07 CN disclosed
CN-1147303-A Optical fiber ferrule MINNESOTA MINING & MFG (US) 1997-04-09 CN disclosed