Water

Water

SCHEMBL4853370

O.P.[CaH2]

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
Fluoride SCHEMBL27811736 0.87
Water SCHEMBL29254161 0.87
Phosphine SCHEMBL121304 0.82
Water SCHEMBL44893 0.82
Water SCHEMBL457728 0.82
Water SCHEMBL486758 0.82
Water SCHEMBL5193902 0.82
Phosphine SCHEMBL9391357 0.82
Phosphine SCHEMBL9579698 0.82
Water SCHEMBL20819244 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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-213895472-U High concentration organic waste water dephosphorization pretreatment systems 上海庞科环境技术有限公司 2021-08-06 CN claimed
CN-107129857-A Wear-resisting environment-friendly type stop-leak compound of antirust and preparation method thereof 江苏海川卓越密封材料有限公司 2017-09-05 CN claimed
CN-118105543-A Vancomycin-carrying hydrogel porous surgical implant for treating infectious bone defect and preparation method thereof 山东大学齐鲁医院 2024-05-31 CN disclosed
CN-117623244-A Method and device for preparing yellow phosphorus raw material from low-grade phosphate rock powder 昆明理工大学 2024-03-01 CN disclosed
CN-116571075-B Method and device for removing phosphorus in yellow phosphorus tail gas boiler by using gangue powder 昆明理工大学 2023-11-24 CN disclosed
CN-116510497-A Method and system for removing sulfur, phosphorus and nitrogen oxides in yellow phosphorus tail gas boiler by using phosphorus ore powder 昆明理工大学 2023-08-01 CN disclosed
CN-213895472-U High concentration organic waste water dephosphorization pretreatment systems 上海庞科环境技术有限公司 2021-08-06 CN disclosed
CN-213895472-U High concentration organic waste water dephosphorization pretreatment systems 上海庞科环境技术有限公司 2021-08-06 CN disclosed
CN-113197151-A Method and system for ecologically controlling cyanobacterial bloom in pond culture water body 集美大学 2021-08-03 CN disclosed
CN-110354874-A The preparation method of the sial phosphorus carrier hydrogenation catalyst of porous structure and preparing the application in bio-fuel 南开大学 2019-10-22 CN disclosed
CN-208732836-U Municipal administration sewage nitrogen and phosphorus removal coupling sludge decrement's device 南宁绿智环保科技有限公司 2019-04-12 CN disclosed
CN-102421463-A Biocompatible composite and its use VIVOXID OY 2012-04-18 CN disclosed
US-RE40516-E1 Composite articles including a fluoropolymer blend 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-09-23 US disclosed
CN-1586202-A Process for preparing compound inorganic germicide UNIV SHANGHAI (CN) 2005-03-02 CN disclosed
EP-1454953-A1 Composite articles including a fluoropolymer blend DYNEON LLC (US) 2004-09-08 EP disclosed
EP-0991519-B1 COMPOSITE ARTICLES INCLUDING A FLUOROPOLYMER BLEND DYNEON LLC (US) 2004-04-21 EP disclosed
CN-1325142-A Method of increasing generated power of solar cell CHEN XING (CN) 2001-12-05 CN disclosed
US-6117508-A COMPOSITES OF BLENDS OF VINYLIDENE FLUORIDE FLUOROPOLYMER AND NONVINYLIDENE FLUORIDE FLUOROPOLYMER WITH AMINE GROUPS DYNEON LLC (US) 2000-09-12 US disclosed
EP-0991519-A1 COMPOSITE ARTICLES INCLUDING A FLUOROPOLYMER BLEND DYNEON LLC (US) 2000-04-12 EP disclosed
WO-1999000249-A1 COMPOSITE ARTICLES INCLUDING A FLUOROPOLYMER BLEND DYNEON LLC (US) 1999-01-07 WO disclosed