Water

Water

SCHEMBL20397372

O.[KH].[LiH]

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 SCHEMBL21065438 1.00
Water SCHEMBL1592726 1.00
Water SCHEMBL20695667 0.87
Water SCHEMBL21433587 0.87
Water SCHEMBL28112087 0.87
Water SCHEMBL23089932 0.87
Water SCHEMBL8466165 0.82
Water SCHEMBL22588912 0.82
Water SCHEMBL15416076 0.82
Water SCHEMBL8369534 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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118217438-A Chitin/chitosan-based surgical suture and preparation method of functional chitin/chitosan-based surgical suture 武汉大学 2024-06-21 CN disclosed
CN-118147785-A Method for efficiently preparing chitin/chitosan hollow fiber and preparation method of functional chitosan hollow fiber 武汉大学 2024-06-07 CN disclosed
CN-117285724-B Chitosan homogeneous solution and preparation method and application thereof 上海其胜生物制剂有限公司 2024-04-30 CN disclosed
CN-117285724-A Chitosan homogeneous solution and preparation method and application thereof 上海其胜生物制剂有限公司 2023-12-26 CN disclosed
CN-117209867-A Method for efficiently preparing chitosan film material 武汉大学 2023-12-12 CN disclosed
CN-117209798-A Method for efficiently dissolving chitosan and application 武汉大学 2023-12-12 CN disclosed
EP-3571267-B1 LUBRICATING OIL COMPOSITIONS AND METHOD FOR PREVENTING OR REDUCING LOW SPEED PRE-IGNITION IN DIRECT INJECTED SPARK-IGNITED ENGINES CHEVRON ORONITE CO (US) 2023-03-29 EP disclosed
EP-4029925-A1 LUBRICATING OIL COMPOSITIONS AND METHOD FOR PREVENTING OR REDUCING LOW SPEED PRE-IGNITION IN DIRECT INJECTED SPARK-IGNITED ENGINES Chevron Oronite Company LLC (US) 2022-07-20 EP disclosed
CN-109721740-B Method for continuously preparing chitin/chitosan solution with different deacetylation degrees 武汉大学 2022-03-15 CN disclosed
CN-111748109-B Chitosan microspheres prepared from chitosan solution with pH value of 6-8 and preparation method thereof 武汉大学 2021-09-24 CN disclosed
CN-111514829-A Method for continuously preparing chitin/chitosan microsphere materials with different deacetylation degrees 武汉大学 2020-08-11 CN disclosed
CN-111518305-A Preparation method of chitosan gel material 武汉大学 2020-08-11 CN disclosed
CN-111518296-A Preparation method of chitosan membrane material 武汉大学 2020-08-11 CN disclosed
CN-111518291-A Preparation method of chitosan microsphere material 武汉大学 2020-08-11 CN disclosed
CN-109721740-A A method of continuously preparing the chitin/chitosan solution of different deacetylations 武汉大学 2019-05-07 CN disclosed
CN-109487096-A High pressure steam process processing lithium ore proposes lithium technique 鲁婷 2019-03-19 CN disclosed
CN-108948377-A A kind of quick dissolution method of chitosan and its application 武汉大学 2018-12-07 CN disclosed
US-20180208872-A1 LUBRICATING OIL COMPOSITIONS AND METHOD FOR PREVENTING OR REDUCING LOW SPEED PRE-IGNITION IN DIRECT INJECTED SPARK-IGNITED ENGINES CHEVRON ORONITE COMPANY LLC 2018-07-26 US disclosed
WO-2018136470-A2 LUBRICATING OIL COMPOSITIONS AND METHOD FOR PREVENTING OR REDUCING LOW SPEED PRE-IGNITION IN DIRECT INJECTED SPARK-IGNITED ENGINES CHEVRON ORONITE COMPANY LLC (US) 2018-07-26 WO disclosed
CN-103290217-B Process for extracting lithium by treating lithium ore by high-pressure steam method INST APPLIED CHEMISTRY JIANGXI ACADEMY SCIENCES 2014-12-17 CN disclosed