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.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL230088 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL6631187 | 0.94 | — | — | |
| Bromide SCHEMBL28103590 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL28103594 | 0.94 | — | — | |
| Iodide SCHEMBL10533464 | 0.94 | — | — | |
| SCHEMBL1877642 | 0.80 | — | — | |
| SCHEMBL18872279 | 0.80 | — | — | |
| SCHEMBL22732394 | 0.80 | — | — | |
| SCHEMBL22732396 | 0.77 | CHRNA7 (0.31) | — | |
| SCHEMBL29415414 | 0.77 | CHRNA7 (0.31) | — |
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 92 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1115656-B1 | INORGANIC OXIDES WITH MESOPOROSITY OR COMBINED MESO-AND MICROPOROSITY AND PROCESS FOR THE PREPARATION THEREOF | UNIV DELFT TECH (NL) | 2015-03-11 | — | — | EP | disclosed |
| US-8399373-B2 | Zeolitic catalysts, their process for preparation and their applications | IFP Energies Nouvelles (FR) | 2013-03-19 | — | — | US | disclosed |
| EP-1214272-B1 | INORGANIC OXIDES WITH MESOPOROSITY OR COMBINED MESO-AND MICROPOROSITY AND PROCESS FOR THE PREPARATION THEREOF | UNIV DELFT TECH (NL) | 2010-10-27 | — | — | EP | disclosed |
| US-20100179361-A1 | Zeolitic Catalysts, Their Process for Preparation and their Applications | IFP (FR) | 2010-07-15 | — | — | US | disclosed |
| EP-1894889-A2 | Novel method for making molecular sieves and novel molecular sieve compositions | ABB Lummus Global Inc. (US) | 2008-03-05 | — | — | EP | disclosed |
| US-6814950-B1 | HEATING WATER, INORGANIC OXIDE, CRYSTALLINE ZEOLITE, AND COMPOUND THAT BINDS INORGANIC OXIDE BY HYDROGEN BONDING, SELECTED FROM: TRIETHANOLAMINE, SULFOLANE, TETRAETHYLPENTAMINE, DIETHYLGYCOLDIBENZOATE, AND A GLYCOL | ABB LUMMUS GLOBAL INC. | 2004-11-09 | — | — | US | disclosed |
| EP-1214272-A1 | INORGANIC OXIDES WITH MESOPOROSITY OR COMBINED MESO-AND MICROPOROSITY AND PROCESS FOR THE PREPARATION THEREOF | Technische Universiteit Delft (NL) | 2002-06-19 | — | — | EP | disclosed |
| US-6358486-B1 | HEATING A MIXTURE COMPRISING WATER, AN INORGANIC OXIDE AND COMPOUND THAT BINDS TO THE INORGANIC OXIDE BY HYDROGEN BONDING TO PRODUCE INORGANIC OXIDE THAT CONTAINS BOTH MICROPORES AND MESOPORES | ABB LUMMUS GLOBAL INC. | 2002-03-19 | — | — | US | disclosed |
| US-6350429-B1 | IMPREGNATION OF CATION OXIDE FRAMEWORK WITH LIQUID TO FORM PORES, SILICON OXIDE WITH METAL OXIDE, ALUMINUM OXIDE AND PHOSPHOROUS OXIDE | ABB LUMMUS GLOBAL INC. | 2002-02-26 | — | — | US | disclosed |
| EP-1115656-A1 | INORGANIC OXIDES WITH MESOPOROSITY OR COMBINED MESO-AND MICROPOROSITY AND PROCESS FOR THE PREPARATION THEREOF | Technische Universiteit Delft (NL) | 2001-07-18 | — | — | EP | disclosed |
| CN-85104262-A | Boron-aluminium-phosphorus-silicon-molecular sieve composition of B-A 1-P-Si-O | — | 1987-02-04 | — | — | CN | disclosed |
| EP-0091049-B1 | ZEOLITE LZ-133 | UNION CARBIDE CORPORATION (US) | 1986-01-08 | — | — | EP | disclosed |
| EP-0161489-A1 | Cobalt-aluminum-phosphorus-silicon-oxide molecular sieves | UNION CARBIDE CORPORATION (US) | 1985-11-21 | — | — | EP | disclosed |
| EP-0161491-A1 | Iron-aluminum-phosphorus-silicon-oxide molecular sieves | UNION CARBIDE CORPORATION (US) | 1985-11-21 | — | — | EP | disclosed |
| EP-0161490-A2 | Manganese-aluminum-phosphorus-silicon-oxide molecular sieves | UNION CARBIDE CORPORATION (US) | 1985-11-21 | — | — | EP | disclosed |
| EP-0161488-A1 | Titanium-aluminum-phosphorus-silicon-oxide molecular sieves | UNION CARBIDE CORPORATION (US) | 1985-11-21 | — | — | EP | disclosed |
| EP-0159624-A2 | Molecular sieve compositions | UOP (US) | 1985-10-30 | — | — | EP | disclosed |
| EP-0158348-A2 | Magnesium-luminum-phosphorus-silicon-oxide molecular sieve compositions | UNION CARBIDE CORPORATION (US) | 1985-10-16 | — | — | EP | disclosed |
| EP-0091049-A1 | Zeolite LZ-133 | UNION CARBIDE CORPORATION (US) | 1983-10-12 | — | — | EP | disclosed |
| EP-0091048-A1 | Zeolite LZ-132 | UNION CARBIDE CORPORATION (US) | 1983-10-12 | — | — | EP | disclosed |