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 SCHEMBL4235152 | 1.00 | — | — | |
| Water SCHEMBL2382437 | 1.00 | — | — | |
| Water SCHEMBL28571077 | 0.87 | — | — | |
| Ammonia Solution, Strong SCHEMBL2849344 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL22686 | 0.82 | — | — | |
| Water SCHEMBL23461833 | 0.67 | — | — | |
| Water SCHEMBL23631871 | 0.67 | — | — | |
| Water SCHEMBL21293770 | 0.67 | — | — | |
| Water SCHEMBL25334174 | 0.67 | — | — | |
| Water SCHEMBL21293771 | 0.67 | — | — |
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 931 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-122057505-A | Pt-Mn/AAO/Al-NAA catalyst and preparation method and application thereof | 华东理工大学 | 2026-05-19 | — | — | CN | claimed |
| WO-2025095858-A1 | METHOD OF ELECTROCHEMICALLY HALOGENATING AN ALKANE | NATIONAL UNIVERSITY OF SINGAPORE (SG) | 2025-05-08 | — | — | WO | claimed |
| CN-119875375-A | Flame-retardant silicone rubber, organic silicone rubber flame-retardant auxiliary agent and preparation method | 浙江新安化工集团股份有限公司 | 2025-04-25 | — | — | CN | claimed |
| CN-119701969-A | SiO with high specific surface area2-Metal oxide composite material, preparation method and application thereof | 太原工业学院 | 2025-03-28 | — | — | CN | claimed |
| CN-115999591-B | Catalyst for preparing arene by dehydrogenating hexatomic cycloalkane and preparation method thereof | 中国石油化工股份有限公司 | 2024-11-15 | — | — | CN | claimed |
| CN-115999596-B | Catalyst for preparing aromatic hydrocarbon by dehydrogenation of six-membered cycloalkane and preparation method thereof | 中国石油化工股份有限公司 | 2024-11-12 | — | — | CN | claimed |
| CN-115999592-B | Naphtha catalytic reforming catalyst and preparation method thereof | 中国石油化工股份有限公司 | 2024-11-12 | — | — | CN | claimed |
| CN-117380188-A | Method for catalytic reforming of naphtha and supported catalyst | 中国石油化工股份有限公司 | 2024-01-12 | — | — | CN | claimed |
| CN-117358232-A | Supported catalyst, preparation method and catalytic reforming method | 中国石油化工股份有限公司 | 2024-01-09 | — | — | CN | claimed |
| CN-117358231-A | Supported catalyst, preparation method and naphtha catalytic reforming method | 中国石油化工股份有限公司 | 2024-01-09 | — | — | CN | claimed |
| CN-102895995-A | Naphtha reforming catalyst and preparation method thereof | CHINA PETROLEUM & CHEMICAL | 2013-01-30 | — | — | CN | claimed |
| CN-102139222-B | Platinum rhenium reforming catalyst and preparation method thereof | CHINA PETROLEUM & CHEMICAL | 2012-12-12 | — | — | CN | claimed |
| CN-102139221-B | Method for preparing platinum-rhenium reforming catalyst | CHINA PETROLEUM & CHEMICAL | 2012-11-14 | — | — | CN | claimed |
| CN-102553632-A | Low carbon alkane dehydrogenation catalyst, preparation method and application thereof | CHINA PETROLEUM & CHEMICAL | 2012-07-11 | — | — | CN | claimed |
| CN-102139221-A | Method for preparing platinum-rhenium reforming catalyst | CHINA PETROLEUM & CHEMICAL | 2011-08-03 | — | — | CN | claimed |
| CN-102139222-A | Platinum rhenium reforming catalyst and preparation method thereof | CHINA PETROLEUM & CHEMICAL | 2011-08-03 | — | — | CN | claimed |
| CN-101293208-B | Reforming catalyst and preparation method thereof | CHINA PETROCHEMICAL CORP | 2010-10-20 | — | — | CN | claimed |
| CN-100478072-C | Hydrocarbons reforming catalyst and its preparation method | CHINA PETRO CHEMICAL CORP SINO (CN) | 2009-04-15 | — | — | CN | claimed |
| CN-101293208-A | Reforming catalyst and preparation method thereof | CHINA PETROCHEMICAL CORP (CN) | 2008-10-29 | — | — | CN | claimed |
| CN-1261219-C | Hydrocarbon reforming catalyst containing molecular sieve | CHINA PETROLEUM & CHEMICAL (CN) | 2006-06-28 | — | — | CN | claimed |