Water

Water

SCHEMBL295897

O.O.[AlH3].[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 SCHEMBL22186684 1.00
Water SCHEMBL20395734 1.00
Water SCHEMBL21878485 1.00
Water SCHEMBL21174912 1.00
Water SCHEMBL5477331 1.00
Water SCHEMBL15161752 1.00
Water SCHEMBL20395735 1.00
Water SCHEMBL23456636 0.87
Hydrochloric Acid SCHEMBL572002 0.87
Water SCHEMBL20959663 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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113666724-A High-strength zirconia-alumina composite ceramic substrate for semiconductor device and method for manufacturing same 九豪精密陶瓷股份有限公司 2021-11-19 CN claimed
CN-106892430-B A kind of preparation method of ultrapure quartz sand 天津天兆御华科技有限公司 2019-07-12 CN claimed
CN-106892430-A A kind of preparation method of ultrapure quartz sand 南京中燊硅基新材料科技有限公司 2017-06-27 CN claimed
US-9072566-B2 Dental implant DENTALPOINT AG (CH) 2015-07-07 US claimed
US-20130209959-A1 INTER LOCKING IMPLANTS PEER MICHAEL (IL) 2013-08-15 US claimed
EP-2170213-B1 DENTAL IMPLANT DENTALPOINT AG (CH) 2012-07-04 EP claimed
EP-2170212-B1 DENTAL IMPLANT DENTALPOINT AG (CH) 2012-03-14 EP claimed
US-20100196850-A1 DENTAL IMPLANT DENTALPOINT AG (CH) 2010-08-05 US claimed
US-20100196851-A1 DENTAL IMPLANT DENTALPOINT AG (CH) 2010-08-05 US claimed
CN-115784775-B Zirconia and alumina gradient composite coating and preparation method thereof 中国国检测试控股集团股份有限公司 2024-02-20 CN disclosed
CN-115784775-A Zirconia and alumina gradient composite coating and preparation method thereof 中国国检测试控股集团股份有限公司 2023-03-14 CN disclosed
CN-113385198-B Ordered mesoporous sulfated zirconium-aluminum composite oxide solid acid material and preparation and application thereof 太原理工大学 2022-08-05 CN disclosed
CN-109867514-B Aluminum oxide-zirconium oxide eutectic ceramic rod for dentistry and preparation method thereof 西北工业大学 2022-03-29 CN disclosed
CN-109867514-B Aluminum oxide-zirconium oxide eutectic ceramic rod for dentistry and preparation method thereof 西北工业大学 2022-03-29 CN disclosed
US-20100196850-A1 DENTAL IMPLANT DENTALPOINT AG (CH) 2010-08-05 US disclosed
US-7726969-B2 Dental implant, in particular of ceramic material WALTHER GERD AXEL 2010-06-01 US disclosed
US-20100081109-A1 DENTAL IMPLANT AND METHOD FOR THE PRODUCTION THEREOF THOMMEN MEDICAL AG (CH) 2010-04-01 US disclosed
US-20080286721-A1 DENTAL IMPLANT, IN PARTICULAR OR CERAMIC MATERIAL WALTHER GERD AXEL 2008-11-20 US disclosed
US-20080213726-A1 Dental Implant and Method for the Production Thereof THOMMEN MEDICAL AG (CH) 2008-09-04 US disclosed
CN-101092732-A Method for preparing ceramic coat with biphase gradients of zirconia and alumina on surface of zirconium base UNIV XI AN JIAOTONG (CN) 2007-12-26 CN disclosed