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 | |
|---|---|---|---|---|
| Water SCHEMBL28737010 | 1.00 | — | — | |
| Water SCHEMBL28290915 | 1.00 | — | — | |
| Water SCHEMBL5133693 | 1.00 | — | — | |
| Water SCHEMBL27602263 | 0.87 | — | — | |
| Water SCHEMBL11756327 | 0.82 | — | — | |
| Water SCHEMBL11853728 | 0.82 | CA1 (0.33) | — | |
| Water SCHEMBL14343007 | 0.82 | CA1 (0.33) | — | |
| Water SCHEMBL11762477 | 0.82 | CA1 (0.33) | — | |
| SCHEMBL80 | 0.82 | — | — | |
| SCHEMBL5398067 | 0.82 | — | — |
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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007136629-A2 | METHODS AND DEVICES FOR HYDROGEN GENERATION FROM SOLID HYDRIDES | MILLENNIUM CELL, INC. (US) | 2007-11-29 | — | — | WO | claimed |
| CN-1980856-A | Systems and methods for hydrogen generation from solid hydrides | MILLENNIUM CELL INC (US) | 2007-06-13 | — | — | CN | claimed |
| WO-2007044452-A1 | SOLID FUEL PACKGING SYSTEM AND METHOD OF HYDROGEN GENERATION | MILLENNIUM CELL, INC. (US) | 2007-04-19 | — | — | WO | claimed |
| US-20070084115-A1 | Solid fuel packaging system and method of hydrogen generation | PROTONEX TECHNOLOGY CORPORATION | 2007-04-19 | — | — | US | claimed |
| US-20070081939-A1 | Solid fuel packaging system and method or hydrogen generation | BERRY GRANT | 2007-04-12 | — | — | US | claimed |
| EP-1747170-A2 | SYSTEMS AND METHODS FOR HYDROGEN GENERATION FROM SOLID HYDRIDES | Millennium Cell Inc. (US) | 2007-01-31 | — | — | EP | claimed |
| US-20060269470-A1 | Methods and devices for hydrogen generation from solid hydrides | MILLENNIUM CELL, INC. | 2006-11-30 | — | — | US | claimed |
| WO-2006093843-A2 | BOROHYDRIDE FUEL COMPOSITIONS AND METHODS | MILLENNIUM CELL, INC. (US) | 2006-09-08 | — | — | WO | claimed |
| US-20060196112-A1 | Borohydride fuel compositions and methods | MILLENNIUM CELL, INC. | 2006-09-07 | — | — | US | claimed |
| WO-2005102914-A2 | SYSTEMS AND METHODS FOR HYDROGEN GENERATION FROM SOLID HYDRIDES | MILLENNIUM, CELL, INC. (US) | 2005-11-03 | — | — | WO | claimed |
| US-20050238573-A1 | Systems and methods for hydrogen generation from solid hydrides | MILLENNIUM CELL, INC. | 2005-10-27 | — | — | US | claimed |
| EP-1072557-B1 | Production of sodium borohydride from sodium borohydride dihydrate in a fluidized bed dryer | ROHM & HAAS (US) | 2003-01-15 | — | — | EP | claimed |
| US-6231825-B1 | FLOWING A STREAM OF DRYING INERT GAS SUCH AS NITROGEN GAS AROUND A PLURALITY OF SODIUM BOROHYDRIDE DIHYDRATE PARTICLES UNTIL THESE PARTICLES ARE CONVERTED TO SODIUM BOROHYDRIDE; DEHYDRATION | ROHM AND HAAS COMPANY | 2001-05-15 | — | — | US | claimed |
| EP-1072557-A1 | Production of sodium borohydride from sodium borohydride dihydrate in a fluidized bed dryer | ROHM AND HAAS COMPANY (US) | 2001-01-31 | — | — | EP | claimed |
| CN-115246850-A | Production method of organic amine borane complex | 威智医药有限公司 | 2022-10-28 | — | — | CN | disclosed |
| CN-114180523-A | Preparation process of sodium borohydride | 上海应用技术大学 | 2022-03-15 | — | — | CN | disclosed |
| EP-2189463-B1 | Synthesis of amine boranes | ROHM & HAAS (US) | 2012-07-04 | — | — | EP | disclosed |
| EP-1072557-A1 | Production of sodium borohydride from sodium borohydride dihydrate in a fluidized bed dryer | ROHM AND HAAS COMPANY (US) | 2001-01-31 | — | — | EP | disclosed |
| EP-1072557-A1 | Production of sodium borohydride from sodium borohydride dihydrate in a fluidized bed dryer | ROHM AND HAAS COMPANY (US) | 2001-01-31 | — | — | EP | disclosed |
| US-3795491-A | METHOD FOR PREPARING AQUEOUS SOLUTIONS OF SODIUM BOROHYDRIDE OF HIGH CONCENTRATION | VENTRON CORP | 1974-03-05 | — | — | US | disclosed |