Water

Water

SCHEMBL3783015

O.O.[Mg+2].[O-2]

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 SCHEMBL29837007 1.00
Water SCHEMBL524342 1.00
Water SCHEMBL29455108 1.00
Water SCHEMBL30225998 1.00
Water SCHEMBL17472953 1.00
Water SCHEMBL3759628 1.00
Water SCHEMBL1177665 1.00
Water SCHEMBL28444587 1.00
Water SCHEMBL8166518 1.00
Water SCHEMBL548597 1.00

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8377833-B2 Laminated material, particularly for an airbag, method for the production thereof, airbag, passive restraint systems comprising an airbag, and gas-tight polyamide polymer film NOLAX AG (CH) 2013-02-19 US claimed
US-20070065614-A1 Laminated material, particularly for an airbag, method for the production thereof, airbag, passive restraint systems comprising an airbag, and gas-tight polyamide polymer film COLLANO XIRO AG (CH) 2007-03-22 US claimed
EP-1518761-B1 Multilayer air bag material, method of making, air bag, passive passenger restraint system comprising air bag and gastight polyamid film COLLANO XIRO AG (CH) 2006-08-02 EP claimed
EP-0237713-B1 FLAME-RETARDANT OLEFINIC RESIN COMPOSITIONS SUMITOMO BAKELITE COMPANY LIMITED (JP) 1993-04-14 EP claimed
US-4732939-A ETHYLENE-ALPHA OLEFIN COPOLYMER GRAFTED WITH POLYSILOXANE AND REACTED WITH METAL HYDRATE SUMITOMO BAKELITE COMPANY LIMITED (JP) 1988-03-22 US claimed
EP-0237713-A2 Flame-retardant olefinic resin compositions SUMITOMO BAKELITE COMPANY LIMITED (JP) 1987-09-23 EP claimed
CN-115003746-B Biodegradable resin composition and molded article 株式会社TBM 2023-11-10 CN disclosed
CN-114207030-B Biodegradable resin composition and molded article 株式会社TBM 2023-10-24 CN disclosed
CN-115003746-A Biodegradable resin composition and molded article 株式会社TBM 2022-09-02 CN disclosed
CN-114929960-A Spun-bonded non-woven fabric prepared from inorganic substance powder 株式会社TBM 2022-08-19 CN disclosed
CN-114599734-A Resin composition and method for producing resin molded article 株式会社TBM 2022-06-07 CN disclosed
CN-114207030-A Biodegradable resin composition and molded article 株式会社TBM 2022-03-18 CN disclosed
CN-110590254-A Cable or cable fitting with a fire-resistant layer 耐克森公司 2019-12-20 CN disclosed
US-8377833-B2 Laminated material, particularly for an airbag, method for the production thereof, airbag, passive restraint systems comprising an airbag, and gas-tight polyamide polymer film NOLAX AG (CH) 2013-02-19 US disclosed
US-20100320736-A1 Airbag NOLAX AG (CH) 2010-12-23 US disclosed
WO-2008107360-A1 AIRBAG NOLAX AG (CH) 2008-09-12 WO disclosed
US-20070065614-A1 Laminated material, particularly for an airbag, method for the production thereof, airbag, passive restraint systems comprising an airbag, and gas-tight polyamide polymer film COLLANO XIRO AG (CH) 2007-03-22 US disclosed
EP-0237713-B1 FLAME-RETARDANT OLEFINIC RESIN COMPOSITIONS SUMITOMO BAKELITE COMPANY LIMITED (JP) 1993-04-14 EP disclosed
US-4732939-A ETHYLENE-ALPHA OLEFIN COPOLYMER GRAFTED WITH POLYSILOXANE AND REACTED WITH METAL HYDRATE SUMITOMO BAKELITE COMPANY LIMITED (JP) 1988-03-22 US disclosed
EP-0237713-A2 Flame-retardant olefinic resin compositions SUMITOMO BAKELITE COMPANY LIMITED (JP) 1987-09-23 EP disclosed