Water

Water

SCHEMBL2238973

C=CCOP(=O)(O)O.O

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 SCHEMBL28310269 0.97 LPAR3 (0.47)
SCHEMBL15847030 0.97 LPAR3 (0.50)
SCHEMBL30321 0.97
Hydrochloric Acid SCHEMBL3262835 0.95
Charcoal, Activated SCHEMBL4957360 0.95
SCHEMBL11598005 0.95
Ethylene SCHEMBL6264686 0.95 LPAR3 (0.48)
SCHEMBL3364236 0.95
SCHEMBL10396225 0.95
SCHEMBL787423 0.95

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-61054035-A None JP disclosed
JP-1251415-A None JP disclosed
JP-59167839-A None JP disclosed
JP-59167840-A None JP disclosed
CN-112237057-B electromagnetic wave absorber 麦克赛尔株式会社 2023-09-12 CN disclosed
CN-112237057-A Electromagnetic wave absorber 麦克赛尔控股株式会社 2021-01-15 CN disclosed
US-7981310-B2 Surface-treating step for a magnetic powder, mixing and stirring a magnetic powder, a dispersant and/or a binder resin, and an organic solvent, while applying a shear force to the composition; and a concentrating until the contents of the non-solvent components reaches 80% HITACHI MAXELL, LTD. (JP) 2011-07-19 US disclosed
US-20080220291-A1 METHOD FOR PREPARING MAGNETIC PAINT AND MAGNETIC RECORDING MEDIUM COMPRISING THE SAME HITACHI MAXELL, LTD. (JP) 2008-09-11 US disclosed
EP-0945757-B1 Coating apparatus FUJI PHOTO FILM CO LTD (JP) 2005-04-20 EP disclosed
US-6767610-B2 MULTILAYER; BACKING CONTAINING CARBON BLACK FUJI PHOTO FILM CO., INC. (JP) 2004-07-27 US disclosed
US-4857402-A Magnetic recording medium FUJI PHOTO FILM CO., LTD. (JP) 1989-08-15 US disclosed
US-4687705-A FERROMAGNETIC PARTICLES PRETREATED WITH ORGANIC COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1987-08-18 US disclosed
US-4664981-A EXCELLENT ELECTROMAGNETIC PROPERTIES FUJI PHOTO FILM CO., LTD. (JP) 1987-05-12 US disclosed
US-4657813-A FERROMAGNETIC PARTICLES OF DIFFERENT GEOMETRIC SHAPES FUJI PHOTO FILM CO., LTD. (JP) 1987-04-14 US disclosed
US-4643941-A MULTILAYER NONMAGNETIC SUPPORT, FERROMAGNETIC ALLOY AND FERRITE MAGNETIC LAYERS FUJI PHOTO FILM CO., LTD. (JP) 1987-02-17 US disclosed
US-4634632-A KNEADING MIXTURE OF FERROMAGNETIC PARTICLES AND VINYL ACETATE-VINYL ALCOHOL-VINYL CHLORIDE POLYMER, ADDING RUBBER FUJI PHOTO FILM CO., LTD. (JP) 1987-01-06 US disclosed
US-4629653-A HIGH DENSITY VIDEO RECORDING FUJI PHOTO FILM CO., LTD. (JP) 1986-12-16 US disclosed
JP-S6154035-A MAGNETIC RECORDING MEDIUM AND ITS PRODUCTION HITACHI MAXELL LTD 1986-03-18 JP disclosed
JP-S59167840-A MAGNETIC RECORDING MEDIUM HITACHI MAXELL LTD 1984-09-21 JP disclosed
JP-S59167839-A MAGNETIC RECORDING MEDIUM HITACHI MAXELL LTD 1984-09-21 JP disclosed