Water

Water

SCHEMBL93875

O.O.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Er+3]

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 SCHEMBL4453163 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL17438109 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL2001437 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL2176539 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL28478211 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL2590832 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL28398822 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL10566608 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL708617 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL10896609 0.94 MEN1 (0.75) 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 272 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12472043-B2 Matte reinforced zirconia abutment adequate for digital scanning and method for manufacturing same PARK TAE SEOK (KR) 2025-11-18 US claimed
EP-4630187-A1 PRODUCTION OF SILVER NANOPARTICLES BY GREEN SYNTHESIS USING HAZELNUT HUSK EXTRACT Bahçesehir Üniversitesi (TR) 2025-10-15 EP claimed
CN-119552638-A RE-MOF-based photo-thermal material, photo-thermal interface evaporator and preparation method and application thereof 中国科学院赣江创新研究院 2025-03-04 CN claimed
WO-2024123268-A1 PRODUCTION OF SILVER NANOPARTICLES BY GREEN SYNTHESIS USING HAZELNUT HUSK EXTRACT BAHCESEHIR UNIVERSITESI (TR) 2024-06-13 WO claimed
CN-118067675-A On-line detection method for trace iron ions in water and trace iron ion indicator 南京工业大学 2024-05-24 CN claimed
CN-118045584-A Manganese-based catalyst for preparing carboxylic ester by oxidative esterification of unsaturated aldehyde, preparation method and production method of carboxylic ester 中国科学院大连化学物理研究所 2024-05-17 CN claimed
CN-117772180-A Method for improving photocatalytic activity of bismuth tungstate, photocatalyst, preparation method thereof and sterilization method 南宁师范大学 2024-03-29 CN claimed
CN-117431581-A Preparation and application of Er-MOF/NiS hydrogen evolution electrocatalyst 西南大学 2024-01-23 CN claimed
CN-117324016-A Method for degrading sulfamethoxazole by activating bicarbonate by using rare earth metal monoatomic catalytic material 华北电力大学 2024-01-02 CN claimed
CN-114538508-B Zirconium dioxide powder and preparation method thereof 深圳陶陶科技有限公司 2023-12-26 CN claimed
CN-109439325-B Magnesium, erbium and ytterbium triple-doped sodium niobate, preparation method thereof and application thereof in optical temperature sensor 广东工业大学 2021-12-24 CN claimed
CN-109321244-B Erbium and ytterbium double-doped lithium niobate up-conversion material, preparation method thereof and application thereof in optical temperature sensor 广东工业大学 2021-12-24 CN claimed
CN-109233829-B Magnesium erbium ytterbium three-doped sodium niobate and preparation method and application thereof 广东工业大学 2021-09-24 CN claimed
CN-109294579-B Lithium erbium ytterbium tri-doped sodium niobate, preparation method thereof and application thereof in optical temperature sensor 广东工业大学 2021-08-24 CN claimed
CN-109294580-B Erbium and ytterbium double-doped sodium niobate up-conversion material, preparation method thereof and application thereof in optical temperature sensor 广东工业大学 2021-08-03 CN claimed
CN-109097043-B Erbium and ytterbium double-doped sodium niobate up-conversion material and preparation method and application thereof 广东工业大学 2021-07-20 CN claimed
CN-112300783-A Lithium niobate up-conversion luminescent material with core-shell structure and preparation method thereof 广东工业大学 2021-02-02 CN claimed
CN-111234808-A Upconversion nano particle modified by nitroso tetrafluoroborate, nano probe, preparation method of nano probe and detection method of sulfur-containing compound 安徽师范大学 2020-06-05 CN claimed
CN-107384402-B Preparation method and application of core-shell hollow enhanced up-conversion material for dye-sensitive solar cell 合肥工业大学 2020-01-17 CN claimed
CN-110591692-A Upconversion nano particle modified by nitroso tetrafluoroborate, nano probe, preparation method of nano probe and detection method of sulfur-containing compound 安徽师范大学 2019-12-20 CN claimed