Water

Water

SCHEMBL659290

O.O.[AlH3].[Ti]

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 SCHEMBL335259 1.00
Water SCHEMBL28133868 1.00
Water SCHEMBL8723237 1.00
Water SCHEMBL21834061 1.00
Water SCHEMBL5147812 1.00
Hydrochloric Acid SCHEMBL15516769 0.87
Water SCHEMBL22273602 0.87
Water SCHEMBL3510082 0.87
Water SCHEMBL9447199 0.87
Water SCHEMBL19946487 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 153 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117860617-A Oil-in-water sun cream and preparation method thereof 广东柏俐臣生物科技有限公司 2024-04-12 CN claimed
CN-114773882-B Titanium dioxide for delustering chinlon chemical fiber and preparation method thereof 天泰(福建)新材料科技有限公司 2022-12-06 CN claimed
CN-114773882-A Titanium dioxide for delustering chinlon chemical fibers and preparation method thereof 天泰(福建)新材料科技有限公司 2022-07-22 CN claimed
CN-109747235-B Protection structure and electronic device 财团法人工业技术研究院 2021-08-03 CN claimed
CN-113020604-A High-strength wear-resistant high-temperature-resistant titanium-aluminum oxide alloy material and preparation method thereof 西安建筑科技大学 2021-06-25 CN claimed
EP-3077545-B1 METHODS FOR SEQUENCING NUCLEIC ACIDS CENTRILLION TECH HOLDINGS CORP (KY) 2020-09-16 EP claimed
CN-110803743-B Preparation method of defect-state titanium oxide-aluminum oxide-graphene ceramic electrode 中国地质大学(北京) 2020-09-15 CN claimed
CN-210916316-U Copper-plated round basin support 嘉兴永发电子有限公司 2020-07-03 CN claimed
US-10597715-B2 Methods for sequencing nucleic acids Centrillion Technology Holdings (KY) 2020-03-24 US claimed
CN-110803743-A Preparation method of defect-state titanium oxide-aluminum oxide-graphene ceramic electrode 中国地质大学(北京) 2020-02-18 CN claimed
CN-109747235-A Protect structure and electronic device 财团法人工业技术研究院 2019-05-14 CN claimed
US-20190140210-A1 PROTECTIVE STRUCTURE AND ELECTRONIC DEVICE INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2019-05-09 US claimed
CN-107095806-A A kind of oily packet emulsion type foundation cream emulsion and preparation method thereof 新时代健康产业(集团)有限公司 2017-08-29 CN claimed
CN-205496657-U PCB cutter with multi -functional composite biocoating 环宇电子科技(昆山)有限公司 2016-08-24 CN claimed
CN-102511500-B Bacteriostatic agent, preparation method thereof and water purifying plant QIDI ELECTRIC GROUP CO LTD 2014-04-02 CN claimed
CN-102511500-A Bacteriostatic agent, preparation method thereof and water purifying plant QIDI ZHOU 2012-06-27 CN claimed
CN-1145687-C Selective hydrogenation catalyst carrier and its prepn and use 中国石油化工股份有限公司 2004-04-14 CN claimed
CN-1364855-A Selective hydrogenization catalyst and its preparing method and use CHINA PETROCHEMICAL CORP (CN) 2002-08-21 CN claimed
CN-1361231-A Selective hydrogenation catalyst carrier and its prepn and use CHINA PETROCHEMICAL CORP LTD (CN) 2002-07-31 CN claimed
CN-2068827-U GOGGLES LU GUIZHI (CN) 1991-01-09 CN claimed