Water

Water

SCHEMBL970907

O.O.O.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Cu+2]

nearest known ligand 0.67

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.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
CA5A P35218 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
TSHR P16473 3/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
HPGD P15428 1/20 0.36
HIF1A Q16665 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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 SCHEMBL1578668 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL27901803 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL208379 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL67093 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL3229957 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL28547967 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL368324 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL19716175 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL7804771 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL3798286 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR

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 1210 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122075782-A Double-waveband optical response bimetallic MOFs modified titanium implant and preparation method and application thereof 2026-05-26 CN claimed
CN-122037641-A Corrosion-resistant protective varnish for automobile air inlet grille and preparation method thereof 长春富维高新汽车饰件有限公司 2026-05-15 CN claimed
CN-122013234-A Anti-poisoning electrocatalytic ammoxidation catalyst based on bimetallic-polyoxometallate interface and preparation method thereof 上海澳思净科技有限公司 2026-05-12 CN claimed
CN-120132882-A Nanowire nickel oxide-copper nitride loaded graphene composite material, preparation method thereof and application thereof in catalyzing ammonia borane hydrolysis hydrogen production 惠州学院 2025-06-13 CN claimed
WO-2025122837-A1 METHOD TO IMPROVE FIRE-RESISTANCE OF WOOD COMPOSITES, CELLULAR SOLIDS AND POROUS MATERIALS VIRGINIA COMMONWEALTH UNIVERSITY (US) 2025-06-12 WO claimed
CN-120118329-A Nitrogen-phosphorus co-doped metal organic framework flame retardant material and preparation method and application thereof 中国地质大学(武汉) 2025-06-10 CN claimed
CN-116514134-B Preparation method of modified 13X molecular sieve with improved adsorption performance and selectivity 宁夏大学 2025-06-03 CN claimed
CN-120059213-A Asymmetric spiral chain Cu-MOF material and preparation method and application thereof 湘潭大学 2025-05-30 CN claimed
CN-117003614-B Preparation method of bio-based 1, 4-butanediol 浙江博聚新材料有限公司 2025-05-23 CN claimed
CN-119900049-A Preparation and application of porous titanium carbide loaded copper molybdenum sulfide electrode material 哈尔滨理工大学 2025-04-29 CN claimed
US-6209343-B1 Portable apparatus for storing and/or transporting biological samples, tissues and/or organs LIFE SCIENCE HOLDINGS, INC. 2001-04-03 US claimed
WO-2000018225-A1 PORTABLE APPARATUS FOR STORING AND/OR TRANSPORTING BIOLOGICAL SAMPLES, TISSUES AND/OR ORGANS ORGAN RECOVERY SYSTEMS, INC. (US) 2000-04-06 WO claimed
US-5788990-A Water-repellent powder and manufacture of the same DOW CORNING TORAY SILICONE CO., LTD. (JP) 1998-08-04 US claimed
EP-0358530-B1 Novel method for producing ceramic bodies DOW CHEMICAL CO (US) 1994-04-20 EP claimed
US-5145833-A Superconductor, yttrium-barium-copper oxide, compression, isostatic pressing THE DOW CHEMICAL COMPANY (US) 1992-09-08 US claimed
WO-1990002715-A1 NOVEL METHOD FOR PRODUCING CERAMIC BODIES THE DOW CHEMICAL COMPANY (US) 1990-03-22 WO claimed
EP-0358530-A2 Novel method for producing ceramic bodies THE DOW CHEMICAL COMPANY (US) 1990-03-14 EP claimed
US-4856294-A Micro-climate control vest MAINSTREAM ENGINEERING CORPORATION (US) 1989-08-15 US claimed
US-4824661-A COPPER SALT, 2,4,4*-TRICHLORO-2*-HYDROXYDIPHENYL ETHER BLENDAX-WERKE R. SCHNEIDER GMBH & CO. (DE) 1989-04-25 US claimed
US-4375425-A Catalyst for the production of a hydrogen-rich gas TEXACO INC. (US) 1983-03-01 US claimed