Water

Water

SCHEMBL864042

O.O=[Pd]

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 SCHEMBL29272028 1.00
Water SCHEMBL9800927 0.89
Water SCHEMBL27441454 0.89
SCHEMBL27368813 0.87
SCHEMBL1340 0.87
SCHEMBL10844705 0.75
SCHEMBL19350074 0.75
Hydrochloric Acid SCHEMBL11873624 0.75
SCHEMBL11581483 0.75
SCHEMBL20854773 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117571801-A Method for rapidly determining nitrate content in palladium chloride 沈阳有色金属研究院有限公司 2024-02-20 CN claimed
CN-116190691-A Preparation method of palladium-nickel composite catalyst 河北师范大学 2023-05-30 CN claimed
CN-113845139-A Preparation method of punctiform nanowire with catalytic performance on ethanol electrooxidation in fuel cell 河北零点新能源科技有限公司 2021-12-28 CN claimed
CN-110132502-B Active material capable of indicating existence of hydrogen through color change 北京航天试验技术研究所 2021-05-25 CN claimed
CN-111662650-A Hydrogen-sensitive color-changing detection adhesive tape and preparation method and application thereof 北京航天试验技术研究所 2020-09-15 CN claimed
CN-110132502-A One kind can indicate active material existing for hydrogen by color change 北京航天试验技术研究所 2019-08-16 CN claimed
EP-3138630-A1 CHEMOCHROMIC NANOPARTICLES, METHOD FOR MANUFACTURING THE SAME, AND HYDROGEN SENSOR COMPRISING THE SAME Hyundai Motor Company (KR) 2017-03-08 EP claimed
US-20170059538-A1 CHEMOCHROMIC NANOPARTICLES, METHOD FOR MANUFACTURING THE SAME, AND HYDROGEN SENSOR COMPRISING THE SAME HYUNDAI MOTOR COMPANY (KR) 2017-03-02 US claimed
CN-104409741-A Carbon-supported palladium oxide oxidation-reduction electro-catalyst and preparation method thereof UNIV CENTRAL SOUTH 2015-03-11 CN claimed
US-20120074094-A1 Manufacturing Method for Forming Circuit Structure on Non-Conductive Carrier KUANG HONG PRECISION CO., LTD. (TW) 2012-03-29 US claimed
EP-1218322-A1 CATALYST COMPOSITION AND PROCESS FOR MAKING THE COMPOSITION Phillips Petroleum Company (US) 2002-07-03 EP claimed
US-20010046943-A1 HYDROCARBON HYDROGENATION CATALYST AND PROCESS CHEVRON PHILLIPS CHEMICAL COMPANY LP 2001-11-29 US claimed
WO-2001041923-A1 HYDROCARBON HYDROGENATION CATALYST AND PROCESS PHILLIPS PETROLEUM COMPANY (US) 2001-06-14 WO claimed
WO-2001019763-A1 CATALYST COMPOSITION AND PROCESS FOR MAKING THE COMPOSITION PHILLIPS PETROLEUM COMPANY (US) 2001-03-22 WO claimed
WO-2000064846-A1 HYDROCARBON HYDROGENATION CATALYST AND PROCESS PHILLIPS PETROLEUM COMPANY (US) 2000-11-02 WO claimed
US-5475121-A Precursor comprising palladium organophosphate complex DSM COPOLYMER,INC. (US) 1995-12-12 US claimed
EP-0512724-B1 Acidic palladium strike bath AT & T CORP (US) 1995-07-05 EP claimed
US-5178745-A Adhesion AT&T BELL LABORATORIES (US) 1993-01-12 US claimed
EP-0512724-A2 Acidic palladium strike bath AT&T Corp. (US) 1992-11-11 EP claimed
US-4193964-A CERAMICS A-T-O INC. (US) 1980-03-18 US claimed