Water

Water

SCHEMBL21333

O.O.O.O.OOB(O)O.[NaH]

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 SCHEMBL10896513 1.00
Water SCHEMBL8587972 1.00
Water SCHEMBL78471 1.00
Water SCHEMBL37908 1.00
Water SCHEMBL80313 1.00
Water SCHEMBL1946236 1.00
SCHEMBL1408311 0.95
Water SCHEMBL6226530 0.95 LMNA (0.30)
Water SCHEMBL3651763 0.95 LMNA (0.30)
Water SCHEMBL61018 0.95

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 9584 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026089670-A1 CELL CULTURE BASAL MEDIA CONTAINING BORON AND BORON DERIVATIVES BOLU ABANT İZZET BAYSAL ÜNİVERSİTESİ (TR) 2026-04-30 WO claimed
US-12570931-B2 Dishwashing agent with bleaching catalyst and Bacillus gibsonii protease HENKEL AG & CO. KGAA (DE) 2026-03-10 US claimed
US-20260001842-A1 METHODS FOR PREPARING L-6-HYDROXYTRYPTOPHAN (HTP) DERIVATIVE AND INTERMEDIATES THEREOF UNIV INNER MONGOLIA (CN) 2026-01-01 US claimed
EP-4633643-A1 USE OF BORON FOR THE TREATMENT OF LEISHMANIASIS DISEASE OF NEURONAL ORIGIN Yeditepe Universitesi (TR) 2025-10-22 EP claimed
EP-4633617-A1 USE OF BORON FOR THE TREATMENT OF LEISHMANIASIS DISEASE Yeditepe Universitesi (TR) 2025-10-22 EP claimed
US-20250051693-A1 DISSOLVABLE AND DISPERSABLE BLEACH SHEET SHEETS LAUNDRY CLUB INC (US) 2025-02-13 US claimed
CN-119118850-A Method for preparing amino phenethyl alcohol compound by reforming indole compound structure 中国科学院兰州化学物理研究所 2024-12-13 CN claimed
CN-119118844-A Method for preparing N-phenyl phenylenediamine compound by structural reforming of imidazole compound 中国科学院兰州化学物理研究所 2024-12-13 CN claimed
CN-118994217-A Purification method and application of alkenyl gem-diboron ester and photodegradable vinyl polymer 北京大学 2024-11-22 CN claimed
US-20240368050-A1 ENHANCED PERFORMANCE UREASE INHIBITOR, COMPOSITIONS AND METHODS THEREOF NANOCHEM SOLUTIONS, INC. (US) 2024-11-07 US claimed
US-4111651-A SULFONIC ANHYDRIDES IN PEROXYGEN BLEACHING FMC CORPORATION (US) 1978-09-05 US claimed
US-4110074-A Mixed carboxylic/sulfonic anhydrides in peroxygen bleaching FMC CORPORATION (US) 1978-08-29 US claimed
US-4107065-A P-ACYLAMINOBENZENESULFONYL CHLORIDE OR BROMIDE COLGATE-PALMOLIVE COMPANY (US) 1978-08-15 US claimed
US-4083793-A ETHYLENE OXIDE FATTY ALCOHOL ADDUCT, POLYOXYETHYLENE GLYCOL MODIFIED WITH FATTY ALCOHOL, SODIUM SOAP, SODIUM ALKYLBENZENESULFONATE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DT) 1978-04-11 US claimed
US-4064062-A SODIUM PERBORATE, TRIAZINE COMPOUND, MOLECULAR SIEVES, FATTY ACID COLGATE-PALMOLIVE (US) 1977-12-20 US claimed
US-4055505-A A HALO-TRIAZINE, ZEOLITE COLGATE-PALMOLIVE COMPANY (US) 1977-10-25 US claimed
US-4000080-A ETHYLENE OXIDE CONDENSATION PRODUCT WITH MALEIC ANHYDRIDE-VINYL METHYL ETHER COPOLYMER THE PROCTER & GAMBLE COMPANY (US) 1976-12-28 US claimed
US-3985862-A REACTING AQUEOUS SODIUM METABORATE AND HYDROGEN PEROXIDE; CRYSTALLIZATION OF SODIUM PERBORATE TETRAHYDRATE DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) 1976-10-12 US claimed
US-3975500-A Process for producing high active oxygen, low bulk density sodium perborate E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-08-17 US claimed
US-3957661-A Fabric softening laundry detergent containing organic esters of phosphoric acid COLGATE-PALMOLIVE COMPANY (US) 1976-05-18 US claimed