Water

Water

SCHEMBL3835534

[Na+].[Na+].[Na+].[OH-].[OH-].[OH-]

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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 SCHEMBL430526 1.00
Water SCHEMBL9003163 1.00 CA1 (0.33)
Water SCHEMBL1313632 1.00 CA1 (0.33)
Water SCHEMBL8984178 1.00 CA1 (0.33)
Water SCHEMBL1333092 1.00
Water SCHEMBL119 1.00
Water SCHEMBL9156696 1.00
Hydrochloric Acid SCHEMBL4599079 0.82
Hydrogen Sulfide SCHEMBL6655618 0.82
Water SCHEMBL5683991 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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1156371-A2 Replenishing method of planographic printing plate developer FUJI PHOTO FILM CO., LTD. (JP) 2001-11-21 EP claimed
US-20230321185-A1 METHOD FOR TREATMENT OF TYPE-1 DIABETES IN A SUBJECT IN NEED THEREOF MOOSAVI AZAM (IR) 2023-10-12 US disclosed
CN-116057345-A Heat exchanger construction for a nuclear reactor 泰拉能源公司 2023-05-02 CN disclosed
CN-114522685-A Gene recombinant human heavy chain ferritin-copper nanoenzyme and preparation method and application thereof 南开大学 2022-05-24 CN disclosed
CN-106999609-B IR dyes for fluorescence imaging 利康公司 2021-04-13 CN disclosed
CN-1671643-B Bipolar trans carotenoid salts and uses thereof DIFFUSION PHARMACEUTICALS LLC 2013-05-29 CN disclosed
US-7595173-B2 Low-cost production of peptides DOW GLOBAL TECHNOLOGIES INC. (US) 2009-09-29 US disclosed
EP-1501935-B1 LOW-COST PRODUCTION OF PEPTIDES DOW GLOBAL TECHNOLOGIES INC (US) 2009-09-23 EP disclosed
EP-1501935-A4 LOW-COST PRODUCTION OF PEPTIDES DOW GLOBAL TECHNOLOGIES INC (US) 2007-05-23 EP disclosed
US-20050227321-A1 Low-cost production of peptides DOW GLOBAL TECHNOLOGIES LLC 2005-10-13 US disclosed
CN-1671643-A Bipolar trans carotenoid salts and uses thereof DIFFUSION PHARMACEUTICALS LLC (US) 2005-09-21 CN disclosed
EP-1501935-A2 LOW-COST PRODUCTION OF PEPTIDES Dow Global Technologies Inc. (US) 2005-02-02 EP disclosed
WO-2003089455-A2 LOW-COST PRODUCTION OF PEPTIDES DOW GLOBAL TECHNOLOGIES INC. (US) 2003-10-30 WO disclosed
US-5411092-A Cementing a well with water and slags SHELL OIL COMPANY (US) 1995-05-02 US disclosed
US-5409063-A Slurrying with water and sodium tripolyphosphate SHELL OIL COMPANY (US) 1995-04-25 US disclosed
US-5409064-A Slurrying with water and sodium pyrophosphate SHELL OIL COMPANY (US) 1995-04-25 US disclosed