Water

Water

SCHEMBL1720710

O.O.O.[Fe].[Fe].[Ni]

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 SCHEMBL28979386 1.00
Water SCHEMBL1428704 1.00
Water SCHEMBL28482069 1.00
Water SCHEMBL16698818 1.00
Water SCHEMBL32679663 0.87
Water SCHEMBL22798861 0.87
Water SCHEMBL31019427 0.87
Water SCHEMBL20485151 0.87
Water SCHEMBL20769871 0.87
Water SCHEMBL4261866 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 62 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109920958-B Functional interlayer of lithium-sulfur battery and preparation method thereof 肇庆市华师大光电产业研究院 2022-02-18 CN claimed
US-11614687-B2 Image forming apparatus and image forming method CANON KABUSHIKI KAISHA (JP) 2023-03-28 US disclosed
CN-109920958-B Functional interlayer of lithium-sulfur battery and preparation method thereof 肇庆市华师大光电产业研究院 2022-02-18 CN disclosed
CN-109920958-B Functional interlayer of lithium-sulfur battery and preparation method thereof 肇庆市华师大光电产业研究院 2022-02-18 CN disclosed
WO-2022004607-A1 TONER FOR DEVELOPMENT OF ELECTROSTATIC IMAGES 日本ゼオン株式会社 2022-01-06 WO disclosed
US-20210165321-A1 IMAGE FORMING APPARATUS AND IMAGE FORMING METHOD CANON KABUSHIKI KAISHA (JP) 2021-06-03 US disclosed
CN-104175615-B A kind of composite of lightweight high connductivity height electromagnetic shielding and preparation method thereof 四川大学 2016-08-17 CN disclosed
CN-104175615-A Light composite material with high conductivity and high electromagnetic shielding and preparation method of composite material UNIV SICHUAN 2014-12-03 CN disclosed
US-8518620-B2 Magnetic toner CANON KABUSHIKI KAISHA (JP) 2013-08-27 US disclosed
CN-102792231-A Toner for developing electrostatic images ZEON CORP 2012-11-21 CN disclosed
CN-1366216-A Developer carrying element, its regeneration method and development apparatus CANON KK (JP) 2002-08-28 CN disclosed
US-20020106219-A1 Image forming apparatus and process cartridge CANON KABUSHIKI KAISHA (JP) 2002-08-08 US disclosed
US-6130018-A Carrier for use in development of electrostatic latent image and image forming apparatus using the carrier KYOCERA MITA CORPORATION (JP) 2000-10-10 US disclosed
EP-0977094-A1 Carrier for use in development of electrostatic latent image and image forming apparatus using the carrier MITA INDUSTRIAL CO. LTD. (JP) 2000-02-02 EP disclosed
EP-0974871-A1 Toner and developer including the same MITA INDUSTRIAL CO. LTD. (JP) 2000-01-26 EP disclosed
EP-0974870-A1 Toner for amorphous silicon photoreceptor and developer including the same MITA INDUSTRIAL CO. LTD. (JP) 2000-01-26 EP disclosed
CN-1159013-A Toner for developing electrostatic image, image forming method and process-cartridge CANON KK (JP) 1997-09-10 CN disclosed
CN-1126848-A A two-component type developer SANDA IND CO LTD (JP) 1996-07-17 CN disclosed
CN-1126846-A Toner for a two-component type developer SANDA IND CO LTD (JP) 1996-07-17 CN disclosed
CN-1095491-A Developing electrostatic images toner, imaging device and toner case CANON KK (JP) 1994-11-23 CN disclosed