Water

Water

SCHEMBL2816989

O.O.[AlH3].[CaH2].[MgH2].[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 SCHEMBL4783387 1.00
Water SCHEMBL3395982 0.91
SCHEMBL23064813 0.89
Water SCHEMBL11622381 0.89
Water SCHEMBL15768078 0.89
Water SCHEMBL3903965 0.89
Water SCHEMBL3397369 0.80
Water SCHEMBL3401046 0.80
Water SCHEMBL21408836 0.80
Water SCHEMBL20483943 0.80

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11624023-B2 Catalyst particles and methods for making same CARBO CERAMICS INC. (US) 2023-04-11 US disclosed
US-20210040380-A1 Catalyst Particles and Methods for Making Same CARBO CERAMICS INC (US) 2021-02-11 US disclosed
US-10752831-B2 Catalytic proppant and methods for making and using same CARBO CERAMICS INC. (US) 2020-08-25 US disclosed
US-20180273837-A1 CATALYTIC PROPPANT AND METHODS FOR MAKING AND USING SAME CARBO CERAMICS INC (US) 2018-09-27 US disclosed
WO-2018170094-A1 CATALYTIC PROPPANT AND METHODS FOR MAKING AND USING SAME CARBO CERAMICS INC. (US) 2018-09-20 WO disclosed
US-9764314-B2 Control of fluid catalytic cracking process for minimizing additive usage in the desulfurization of petroleum feedstocks SAUDI ARABIAN OIL COMPANY (SA) 2017-09-19 US disclosed
EP-2576733-A1 CONTROL OF FLUID CATALYTIC CRACKING PROCESS FOR MINIMIZING ADDITIVE USAGE IN THE DESULFURIZATION OF PETROLEUM FEEDSTOCKS Saudi Arabian Oil Company (SA) 2013-04-10 EP disclosed
WO-2011149763-A1 CONTROL OF FLUID CATALYTIC CRACKING PROCESS FOR MINIMIZING ADDITIVE USAGE IN THE DESULFURIZATION OF PETROLEUM FEEDSTOCKS SAUDI ARABIAN OIL COMPANY (SA) 2011-12-01 WO disclosed
US-20100230324-A1 Control of Fluid Catalytic Cracking Process for Minimizing Additive Usage in the Desulfurization of Petroleum Feedstocks SAUDI ARABIAN OIL COMPANY (SA) 2010-09-16 US disclosed