Water

Water

SCHEMBL597252

O.O.O.[Cr]

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 SCHEMBL1134216 1.00
Water SCHEMBL1773234 1.00
Water SCHEMBL11517476 1.00
Water SCHEMBL3924078 1.00
Water SCHEMBL8960314 1.00
Water SCHEMBL9011506 1.00
Water SCHEMBL10610102 1.00
Water SCHEMBL15803 1.00
Water SCHEMBL11706166 1.00
Water SCHEMBL4426501 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 1111 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4728107-A2 COMPOSITIONS, APPARATUS, SYSTEMS AND METHODS FOR EXTRACTING A METAL FROM AN AQUEOUS SOLUTION Energy Exploration Technologies, Inc. (US) 2026-04-22 EP claimed
WO-2025226865-A1 COMPOSITIONS, SYSTEMS AND METHODS FOR ADSORBING AT LEAST ONE METAL FROM A SOLUTION ENERGY EXPLORATION TECHNOLOGIES, INC. (US) 2025-10-30 WO claimed
WO-2024259209-A2 COMPOSITIONS, APPARATUS, SYSTEMS AND METHODS FOR EXTRACTING A METAL FROM AN AQUEOUS SOLUTION ENERGY EXPLORATION TECHNOLOGIES, INC. (US) 2024-12-19 WO claimed
CN-113145102-A Supported catalyst, preparation and application thereof 中国石油天然气股份有限公司 2021-07-23 CN claimed
US-10895521-B2 Full-view-field quantitative statistical distribution characterization method of precipitate particles in metal material CENTRAL IRON AND STEEL RESEARCH INSTITUTE (CN) 2021-01-19 US claimed
CN-111326594-A Colored coating, photovoltaic module with colored coating and preparation method of photovoltaic module 杭州纤纳光电科技有限公司 2020-06-23 CN claimed
EP-3221331-B1 6-ALKYL-7-HYDROXY-4-EN-3-ONE STEROIDS AS INTERMEDIATES FOR THE PRODUCTION OF STEROIDAL FXR MODULATORS NZP UK LTD (GB) 2019-09-18 EP claimed
EP-3221333-B1 6.ALPHA.-ALKYL-3,7-DIONE STEROIDS AS INTERMEDIATES FOR THE PRODUCTION OF STEROIDAL FXR MODULATORS NZP UK LTD (GB) 2019-07-24 EP claimed
US-20190204199-A1 FULL-VIEW-FIELD QUANTITATIVE STATISTICAL DISTRIBUTION CHARACTERIZATION METHOD OF PRECIPITATE PARTICLES IN METAL MATERIAL CENTRAL IRON AND STEEL RESEARCH INSTITUTE (CN) 2019-07-04 US claimed
US-10301350-B2 6-alkyl-7-hydroxy-4-en-3-one steroids as intermediates for the production of steroidal FXR modulators NZP UK Limited (GB) 2019-05-28 US claimed
CN-1082624-A Method for treating cast pipe crystallizer surface with alloy permeation HUATONG APPLIC TECHNOLOGY I SH (CN) 1994-02-23 CN claimed
US-5231066-A Bimodal silica gel, its preparation and use as a catalyst support QUANTUM CHEMICAL CORPORATION (US) 1993-07-27 US claimed
CN-1072178-A New preparation 1R, cis-2, the method and the halo intermediate of the lactone of 2-dimethyl-3-formyl radical cyclopropane-1-carboxylic acid ROUSSEL UCLAF (FR) 1993-05-19 CN claimed
CN-1036979-A Non-ferrous-metal water tank mending-leakage, cleaning, cooling agent and production method thereof ZHU ZHENGGANG (CN) 1989-11-08 CN claimed
CN-1004711-B Micro-crack chromium electroplating solution and electroplating method 北京市理化分析测试中心 1989-07-05 CN claimed
CN-1032351-A Magnesite refractory wedding agent and using method thereof ANSHAN THERMAL ENERGY INST MIN (CN) 1989-04-12 CN claimed
CN-87105898-A N-(sProcess and intermediates for the preparation of -3-alkylheptanoyl -D-r-glutamyl -glycyl -D-alanyl 1988-03-09 CN claimed
CN-85105959-A The fluid composition that process metal surfaces is used 1987-03-04 CN claimed
US-4157944-A ANODIC TREATMENT, CATHODIC TREATMENT AN ACID CHROMATE ELECTROLYTE SELECTED FROM CHROMIC TRIOXIDE, ALKALINE METAL CHROMATES AND DICHROMATES, AMMONIUM CHROMATE AND DICHROMATE MIGITA PATENT OFFICE (JP) 1979-06-12 US claimed
US-4084968-A Method of manufacturing electrically conductive metal layers on substrates U.S. PHILIPS CORPORATION (US) 1978-04-18 US claimed