Water

Water

SCHEMBL44893

O.P

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 SCHEMBL27696433 1.00
Water SCHEMBL11525574 1.00
Water SCHEMBL28972971 1.00
Water SCHEMBL27488528 1.00
Water SCHEMBL20819244 1.00
Water SCHEMBL23497089 0.82
Water SCHEMBL21987115 0.82
Water SCHEMBL21001003 0.82
Water SCHEMBL22972927 0.82
Water SCHEMBL21359897 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

Appears in 5552 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12630744-B2 Polishing compositions and methods of use thereof FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2026-05-19 US claimed
EP-4688987-A1 POLISHING COMPOSITIONS AND METHODS OF USE THEREOF FUJIFILM Electronic Materials U.S.A, Inc. (US) 2026-02-11 EP claimed
EP-4626996-A1 POLISHING COMPOSITIONS AND METHODS OF USE THEREOF FUJIFILM Electronic Materials U.S.A, Inc. (US) 2025-10-08 EP claimed
CN-115636791-B Non-halogen ionic liquid pair CO2Method for synthesizing carbonic ester by absorption-in-situ conversion 中国科学院过程工程研究所 2025-06-17 CN claimed
CN-119822929-A Fluorescent ion probe based on dihydroxynaphthalene and preparation method and application thereof in detecting diquat 浙江工业大学 2025-04-15 CN claimed
EP-4347668-B1 PROCESS FOR RECOVERING QUATERNARY SALT BROMINATION CATALYST DDP SPECIALTY ELECTRONIC MATERIALS US LLC (US) 2025-04-02 EP claimed
CN-119684586-A Polyether base oil and preparation method thereof 万华化学集团股份有限公司 2025-03-25 CN claimed
CN-119490197-A High-silicon EMT molecular sieve and synthetic method and application thereof 中国科学院大连化学物理研究所 2025-02-21 CN claimed
EP-3305406-B1 HYDROTREATING CATALYST FOR HYDROCARBON OIL, PROCESS FOR PRODUCING SAME, AND HYDROTREATING METHOD JGC CATALYSTS & CHEMICALS LTD (JP) 2025-01-01 EP claimed
US-20240327675-A1 POLISHING COMPOSITIONS AND METHODS OF USE THEREOF FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. 2024-10-03 US claimed
US-4451262-A After-treatment of finished, cellulose-containing fibrous materials with liquid ammonia CIBA-GEIGY CORPORATION (US) 1984-05-29 US claimed
US-4438254-A REACTING VICINAL EPOXIDES WITH PHENOLS OR THIOPHENOLS IN PRESENCE OF ANHYDROUS TETRAHYDROCARBONYL PHOSPHONIUM COMPOUND THE DOW CHEMICAL COMPANY (US) 1984-03-20 US claimed
EP-0064328-A1 Zeolite and catalytic conversion therewith MOBIL OIL CORPORATION (US) 1982-11-10 EP claimed
US-4319926-A DURABLE PROTECTIVE COATINGS PPG INDUSTRIES, INC. (US) 1982-03-16 US claimed
EP-0000694-B1 PROCESS FOR THE PREPARATION OF QUATERNARY PHOSPHONIUM HYDROXIDES HOECHST AKTIENGESELLSCHAFT (DE) 1980-09-17 EP claimed
US-4189449-A FROM DI- OR TRIMETHYLPHOSPHINE AND AN EPOXIDE, ALKALINE AQUEOUS MEDIUM HOECHST AKTIENGESELLSCHAFT (DE) 1980-02-19 US claimed
EP-0000694-A1 Process for the preparation of quaternary phosphonium hydroxides HOECHST AKTIENGESELLSCHAFT (DE) 1979-02-21 EP claimed
US-4076755-A FROM PHOSPHINES AND ALDEHYDES OR KETONES HOECHST AKTIENGESELLSCHAFT (DT) 1978-02-28 US claimed
US-4070224-A POLYURETHANES ALLIED RESIN CORPORATION (US) 1978-01-24 US claimed
US-3978025-A COATINGS FOR ELECTRICAL CONDUCTORS RHONE-POULENC S.A. (FR) 1976-08-31 US claimed